Enthalpies of sublimation and formation of polycyclic aromatic hydrocarbons (PAHs) derived from comparative molecular field analysis (CoMFA): Application of moment of inertia for molecular alignment

William J. Welsh; Weida Tong; Elizabeth R. Collantes; James S. Chickos; Sergei G. Gagarin

doi:10.1016/S0040-6031(96)03048-1

Enthalpies of sublimation and formation of polycyclic aromatic hydrocarbons (PAHs) derived from comparative molecular field analysis (CoMFA): Application of moment of inertia for molecular alignment

William J. Welsh
, Weida Tong
, Elizabeth R. Collantes
, James S. Chickos
, Sergei G. Gagarin

University of Missouri-St. Louis

Research output: Contribution to journal › Article › peer-review

Original language	American English
Journal	Thermochimica Acta
Volume	290
DOIs	https://doi.org/10.1016/S0040-6031(96)03048-1
State	Published - Jan 1 1997

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Organic Chemistry

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Enthalpies of sublimation and formation of polycyclic aromatic hydrocarbons (PAHs) derived from comparative molecular field analysis (CoMFA): Application of moment of inertia for molecular alignment. / Welsh, William J.; Tong, Weida; Collantes, Elizabeth R. et al.
In: Thermochimica Acta, Vol. 290, 01.01.1997.

Research output: Contribution to journal › Article › peer-review

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title = "Enthalpies of sublimation and formation of polycyclic aromatic hydrocarbons (PAHs) derived from comparative molecular field analysis (CoMFA): Application of moment of inertia for molecular alignment",

author = "Welsh, \{William J.\} and Weida Tong and Collantes, \{Elizabeth R.\} and Chickos, \{James S.\} and Gagarin, \{Sergei G.\}",

note = "A Quantitative Structure-Property Relationship (QSPR) is developed from the 3D-QSAR method CoMFA to estimate the sublimation enthalpy (ΔsubH0m (298.15...",

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AU - Welsh, William J.

AU - Tong, Weida

AU - Collantes, Elizabeth R.

AU - Chickos, James S.

AU - Gagarin, Sergei G.

N1 - A Quantitative Structure-Property Relationship (QSPR) is developed from the 3D-QSAR method CoMFA to estimate the sublimation enthalpy (ΔsubH0m (298.15...

PY - 1997/1/1

Y1 - 1997/1/1

UR - https://www.sciencedirect.com/science/article/pii/S0040603196030481

U2 - 10.1016/S0040-6031(96)03048-1

DO - 10.1016/S0040-6031(96)03048-1

M3 - Article

VL - 290

JO - Thermochimica Acta

JF - Thermochimica Acta

ER -

Enthalpies of sublimation and formation of polycyclic aromatic hydrocarbons (PAHs) derived from comparative molecular field analysis (CoMFA): Application of moment of inertia for molecular alignment

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