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1

Investigation on quantitative relationship between chemical shift of carbon-13 nuclear magnetic resonance spectra and molecular topological structure based on a novel atomic distance–edge vector (ADEV)

Shushen Liu, Hailing Liu, Banmei Yu, Chenzhong Cao, Shengshi Zhiliang Li

Journal:

Journal of Chemometrics

Year:

2001

Language:

english

File:

PDF, 100 KB

english, 2001

2

Theoretical prediction of the Kovat's retention index for oxygen-containing organic compounds using novel topological indices

Fengping Liu, Yizeng Liang, Chenzhong Cao, Neng Zhou

Journal:

Analytica Chimica Acta

Year:

2007

Language:

english

File:

PDF, 251 KB

english, 2007

3

Extending bond orbital-connection matrix method to the QSPR study of alkylbenzenes: Some thermochemical properties

Shuo Gao, Chenzhong Cao

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2006

Language:

english

File:

PDF, 183 KB

english, 2006

4

A Quantitative Structure-Property Relationship (QSPR) Study of Aliphatic Alcohols by the Method of Dividing the Molecular Structure into Substructure

Liu, Fengping, Cao, Chenzhong, Cheng, Bin

Journal:

International Journal of Molecular Sciences

Year:

2011

Language:

english

File:

PDF, 335 KB

english, 2011

5

Molecular Distance-Edge Vector (μ) and Chromatographic Retention Index of Alkanes

Liu, Shushen, Liu, Hailing, Xia, Zhining, Cao, Chenzhong, Li, Zhiliang S.

Journal:

Journal of the Chinese Chemical Society

Year:

2000

Language:

english

File:

PDF, 474 KB

english, 2000

6

Influence of the side-group at C=N bridging bond of bis-aryl Schiff bases on the wavelength of absorption maximum of ultraviolet absorption spectra

Luo, Qingqing, Cao, Chao-Tun, Cao, Zhongzhong, Cao, Chenzhong

Journal:

Journal of Physical Organic Chemistry

Year:

2016

Language:

english

File:

PDF, 646 KB

english, 2016

7

ChemInform Abstract: Molecular Distance—Edge Vector (μ): An Extension from Alkanes to Alcohols.

Shushen Liu, Hailing Liu, Zhining Xia, Chenzhong Cao, Zhiliang Li

Journal:

Year:

2000

File:

PDF, 27 KB

2000

8

ChemInform Abstract: Molecular Polarizability. Part 2. Relationship to the Boiling Point of Alkanes and Alcohols.

Chenzhong Cao, Shusheng Liu, Zhiliang Li

Journal:

Year:

2000

File:

PDF, 24 KB

2000

9

ChemInform Abstract: Molecular Polarizability. Part 3. Relationship to the Ionization Potential of Haloalkanes, Amines, Alcohols, and Ethers.

Chenzhong Cao, Hua Yuan, Shengli Liu, Rongjin Zeng

Journal:

Year:

2000

File:

PDF, 24 KB

2000

10

ChemInform Abstract: Molecular Electronegative Distance Vector (MEDV) Related to 15 Properties of Alkanes.

Shushen Liu, Shaoxi Cai, Chenzhong Cao, Zhiliang Li

Journal:

Year:

2001

File:

PDF, 25 KB

2001

11

ChemInform Abstract: Topological Indices Based on Vertex, Distance, and Ring: The Boiling Points of Paraffins and Cycloalkanes.

Chenzhong Cao, Hua Yuan

Journal:

Year:

2001

File:

PDF, 25 KB

2001

12

ChemInform Abstract: Molecular Polarizability. Part 4. Evaluation of the Ionization Potential for Alkanes and Alkenes with Polarizability.

Chenzhong Cao, Hua Yuan

Journal:

Year:

2002

File:

PDF, 24 KB

2002

13

A New Approach of Evaluating Bond Dissociation Energy from Eigenvalue of Bonding Orbital-Connection Matrix for C—C and C—H Bonds in Alkane.

Chenzhong Cao, Hua Yuan

Journal:

Year:

2003

File:

PDF, 57 KB

2003

14

Topological Indices Based on Vertex, Edge, Ring, and Distance: Application to Various Physicochemical Properties of Diverse Hydrocarbons.

Hua Yuan, Chenzhong Cao

Journal:

Year:

2003

File:

PDF, 57 KB

2003

15

Topological Steric Effect Index and Its Application.

Chenzhong Cao, Li Liu

Journal:

Year:

2004

File:

PDF, 49 KB

2004

16

Slater-Like Model for Carbon 1s Core Ionization Energies of Halomethanes

Journal:

Year:

2006

Language:

english

File:

PDF, 93 KB

english, 2006

17

QSPR modeling of thermal conductivity detection response factors for diverse organic compound

Fengping Liu, Yizeng Liang, Chenzhong Cao

Journal:

Chemometrics and Intelligent Laboratory Systems

Year:

2006

Language:

english

File:

PDF, 132 KB

english, 2006

18

Estimating enthalpies of formation of monoalkenes by the bonding orbital-connecting matrix of molecular graphics and the steric effect of the cis/trans configuration

Chenzhong Cao, Shuo Gao

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2005

Language:

english

File:

PDF, 149 KB

english, 2005

19

Exploration of a general expression to estimate the enthalpies of formation for monosubstituted alkanes RX

Chenzhong Cao, Shuo Gao, Rongjin Zeng

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2005

Language:

english

File:

PDF, 164 KB

english, 2005

20

Quantitative structure–retention relationship studies for predicting the gas chromatography retention indices of polycyclic aromatic hydrocarbons: Quasi-length of carbon chain and pseudo-conjugated system surface

Jijun Kang, Chenzhong Cao, Zhiliang Li

Journal:

Journal of Chromatography A

Year:

1998

Language:

english

File:

PDF, 84 KB

english, 1998

21

The link between the ionization potential and heat of formation for organic homologous compounds

Journal:

Journal of Physical Organic Chemistry

Year:

2007

Language:

english

File:

PDF, 112 KB

english, 2007

22

Excited-state substituent constants σ from substituted benzenes

Chenzhong Cao, Guanfan Chen, Zhiqing Yin

Journal:

Journal of Physical Organic Chemistry

Year:

2008

Language:

english

File:

PDF, 173 KB

english, 2008

23

Substituent effect on the UV spectra of p-disubstituted compounds XPh(CHCHPh)nY (n = 0, 1, 2)

Guanfan Chen, Chenzhong Cao

Journal:

Journal of Physical Organic Chemistry

Year:

2010

Language:

english

File:

PDF, 149 KB

english, 2010

24

Investigation of the substituent specific cross-interaction effects on 13C NMR of the CN bridging group in substituted benzylidene anilines

Chenzhong Cao, Bingtao Lu, Guanfan Chen

Journal:

Journal of Physical Organic Chemistry

Year:

2011

Language:

english

File:

PDF, 179 KB

english, 2011

25

Estimation of the ionization potential for polyhalogenated hydrocarbons by weakest bound potential method

Yaxin Wu, Chenzhong Cao, Hua Yuan

Journal:

Journal of Physical Organic Chemistry

Year:

2012

Language:

english

File:

PDF, 639 KB

english, 2012

26

Determination of Carbon 1s Core Ionization Energies in Saturated Molecules

Journal:

Molecular Informatics

Year:

2008

Language:

english

File:

PDF, 564 KB

english, 2008

27

Topological Electronegativity Index and Its Application – I. Ionization Potentials of Alkyl Groups and Alkyl Halides

Chenzhong Cao, Jinhua Luo

Journal:

Molecular Informatics

Year:

2007

Language:

english

File:

PDF, 112 KB

english, 2007

28

Topological Electronegativity Index and Its Application 2. Enthalpies of Formation for Monosubstituted Alkanes RX

Journal:

Molecular Informatics

Year:

2008

Language:

english

File:

PDF, 246 KB

english, 2008

29

Quantitative Structure-Retention Relationship Study of Mercapto-Compounds by the Method of Dividing the Molecular Structure into Substructure

Fengping Liu, Chenzhong Cao, Xun Li

Journal:

Molecular Informatics

Year:

2009

Language:

english

File:

PDF, 255 KB

english, 2009

30

Artificial neural network prediction of glass transition temperature of polymers

Wanqiang Liu, Chenzhong Cao

Journal:

Colloid & Polymer Science

Year:

2009

Language:

english

File:

PDF, 181 KB

english, 2009

31

Influence of steric and intramolecular inductive effects on the variable trends in R-X (R=Alkyl) bond dissociation energy

Journal:

Science China Chemistry

Year:

2009

Language:

english

File:

PDF, 672 KB

english, 2009

32

Effects of substituent and solvent on the UV absorption energy of 4,4′-disubstituted stilbenes

ChenZhong Cao, GuanFan Chen, YaXin Wu

Journal:

Science China Chemistry

Year:

2011

Language:

english

File:

PDF, 764 KB

english, 2011

33

Opposing Influences of Ruffling and Doming Deformation on the 4-N Cavity Size of Porphyrin Macrocycles: The Role of Heme Deformations Revealed

Dr. Zaichun Zhou, Min Shen, Prof. Chenzhong Cao, Qiuhua Liu, Ziqiang Yan

Journal:

Chemistry - A European Journal

Year:

2012

Language:

english

File:

PDF, 341 KB

english, 2012

34

The substituent effect on the UV energy of 4,4′-disubstituted benzylideneanilines

Guanfan Chen, Chenzhong Cao, Bingtao Lu, Bin Sheng

Journal:

Journal of Physical Organic Chemistry

Year:

2012

Language:

english

File:

PDF, 472 KB

english, 2012

35

Substituent effect study on δc values of the bridge group carbons in disubstituted cinnamyl aniline series

Guanfan Chen, Chenzhong Cao, Bin Sheng, Yun Zhu, Zhenxing Wu, Xiangsi Wu

Journal:

Journal of Physical Organic Chemistry

Year:

2012

Language:

english

File:

PDF, 506 KB

english, 2012

36

Substituent effects on the 13C NMR chemical shifts of the imine carbon in N-(4-X–benzylidene)-4-(4-Y–styryl) anilines

Zhengjun Fang, Chenzhong Cao, Guanfan Chen

Journal:

Journal of Physical Organic Chemistry

Year:

2012

Language:

english

File:

PDF, 1.07 MB

english, 2012

37

Determining the excited-state substituent constants σCCex of meta-substituent from 3,4'-disubstituted stilbenes

Chenzhong Cao, Bin Sheng, Guanfan Chen

Journal:

Journal of Physical Organic Chemistry

Year:

2012

Language:

english

File:

PDF, 332 KB

english, 2012

38

Crystal structures and fungicidal activities of anti-2,4-bis(X-phenyl)pentane-2,4-diols

Yinchun Jiao, Chenzhong Cao, Xiaolin Zhao

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 1015 KB

english, 2012

39

QSPR study of GC retention indices for saturated esters on seven stationary phases based on novel topological indices

Fengping Liu, Yizeng Liang, Chenzhong Cao, Neng Zhou

Journal:

Year:

2007

Language:

english

File:

PDF, 147 KB

english, 2007

40

The alternating of substituent effect on the 13C NMR shifts of all bridge carbons in cinnamyl aniline derivatives

Guanfan Chen, Chenzhong Cao, Yun Zhu, Zhenxing Wu, Xiangsi Wu

Journal:

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

Year:

2012

Language:

english

File:

PDF, 265 KB

english, 2012

41

The Relation Between the Ionization Potential and the Molecular Electronegativity of Organic Homologs

Chenzhong, Cao.

Journal:

Journal of Chemical Education

Year:

1993

Language:

english

File:

PDF, 2.46 MB

english, 1993

42

Recent progress in quantifying substituent effects

ChenZhong Cao, YaXin Wu

Journal:

Science China Chemistry

Year:

2013

Language:

english

File:

PDF, 1.15 MB

english, 2013

43

An extending evidence of molecular conformation on spectroscopic properties of symmetrical bis-Schiff bases

Fang, Zhengjun, Cao, Chenzhong, Chen, Jianfang, Deng, Xingchen

Journal:

Journal of Molecular Structure

Year:

2014

Language:

english

File:

PDF, 755 KB

english, 2014

44

Effect of molecular conformation on spectroscopic properties of symmetrical Schiff bases derived from 1,4-phenylenediamine

Fang, Zhengjun, Cao, Chenzhong

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 467 KB

english, 2013

45

Substituent effects on the UV spectra of extended benzylidene anilines p-XPhCHNPhCHCHPhp-Y

Cao, Chenzhong, Fang, Zhengjun

Journal:

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

Year:

2013

Language:

english

File:

PDF, 464 KB

english, 2013

46

An attempt of molecular design and synthesis of 3,4′/4,3′-disubstituted benzylideneanilines with specified UV-Vis absorption maximum wavelength

Wang, Linyan, Cao, Chaotun, Cao, Chenzhong

Journal:

Journal of Physical Organic Chemistry

Year:

2014

Language:

english

File:

PDF, 435 KB

english, 2014

47

Bis(zinc porphyrin) Bridged by Benzo Orthocarbonates as a Conformational Switch under Regulation of DABCO and a Cu + Ion

Zhou, Zaichun, Cao, Chenzhong, Yin, Zhiqing, Liu, Qiuhua

Journal:

Organic Letters

Year:

2009

Language:

english

File:

PDF, 676 KB

english, 2009

48

Hybrid Orbital Deformation (HOD) Effect and Spectral Red-Shift Property of Nonplanar porphyrin

Zhou, Zaichun, Cao, Chenzhong, Liu, Qiuhua, Jiang, Rongqing

Journal:

Organic Letters

Year:

2010

Language:

english

File:

PDF, 1.12 MB

english, 2010

49

Two Dominant Factors Influencing the Impact Sensitivities of Nitrobenzenes and Saturated Nitro Compounds

Cao, Chenzhong, Gao, Shuo

Journal:

Journal of Physical Chemistry B

Year:

2007

Language:

english

File:

PDF, 68 KB

english, 2007

50

Conversion of Electron Configuration of Iron Ion through Core Contraction of Porphyrin: Implications for Heme Distortion

Zhou, Zaichun, Liu, Qiuhua, Yan, Ziqiang, Long, Ge, Zhang, Xi, Cao, Chenzhong, Jiang, Rongqing

Journal:

Organic Letters

Year:

2013

Language:

english

File:

PDF, 914 KB

english, 2013