Geometry & MOs

Info

ID:	327256
PubChem CID:	126689350
Reduced:	FNOC12H14 (1)
Stoich.:	ABCD12E14 (1)
Weight, g/mol:	476.16714
ΔH_f, kcal/mol:	-82.59
Dipole, Da:	3.88
IP(EA), eV:	-9.65(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2,3-dihydroxypropyl)-5-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]benzimidazol-2-yl]-3-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CC1(C(CNC1=O)C2=CC=C(C=C2)F)C

DOS

IR

Vibrations