Geometry & MOs

Info

ID:	161944
PubChem CID:	57393130
Reduced:	SN2O4C32H38 (1)
Stoich.:	AB2C4D32E38 (1)
Weight, g/mol:	373.142641
ΔH_f, kcal/mol:	-129.64
Dipole, Da:	7.58
IP(EA), eV:	-8.37(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-7-hydroxy-N-[(3-hydroxyphenyl)methyl]-1H-benzimidazole-4-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC2=C1C(CC(C2)C(C)C)CC3=CC=CC=C3)NC(=O)NC/C=C/C4=CC=C(C=C4)OC

DOS

IR

Vibrations