Geometry & MOs

Info

ID:	150976
PubChem CID:	53790673
Reduced:	NO4C24H31 (1)
Stoich.:	AB4C24D31 (1)
Weight, g/mol:	516.111981
ΔH_f, kcal/mol:	-177.05
Dipole, Da:	5.35
IP(EA), eV:	-8.79(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dichloropyridin-4-yl)-2-[(1S)-1,2-diphenylethyl]-7-methoxy-1H-benzimidazole-4-carboxamide

Drug info:

PubChemData

Smile

CCCCCC(=O)OC1=CC=C(C2=CC=CC=C21)C3CC(=O)N(C3CO)C(C)C

DOS

IR

Vibrations