Geometry & MOs

Info

ID:	327242
PubChem CID:	126689320
Reduced:	FO2C5H9 (1)
Stoich.:	AB2C5D9 (1)
Weight, g/mol:	488.203525
ΔH_f, kcal/mol:	-163.9
Dipole, Da:	2.64
IP(EA), eV:	-11.31(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(1-acetylpiperidin-3-yl)-1-(3-hydroxypropyl)benzimidazol-2-yl]-3-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CCC(OC(=O)C)F

DOS

IR

Vibrations