Geometry & MOs

Info

ID:	149063
PubChem CID:	53788734
Reduced:	OC4H4 (4)
Stoich.:	AB4C4 (4)
Weight, g/mol:	391.029747
ΔH_f, kcal/mol:	-141.19
Dipole, Da:	2.7
IP(EA), eV:	-8.83(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-chlorophenyl)pyridin-3-yl]-2-(2,4-dichlorophenyl)propan-1-ol

Drug info:

PubChemData

Smile

CC(=O)C1=C(C2=CC=CC=C2C=C1)OCCCC(=O)O

DOS

IR

Vibrations