Geometry & MOs

Info

ID:	43597
PubChem CID:	10321518
Reduced:	ON3H11C13 (2)
Stoich.:	AB3C11D13 (2)
Weight, g/mol:	450.136176
ΔH_f, kcal/mol:	21.26
Dipole, Da:	5.57
IP(EA), eV:	-8.34(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-hydroxy-N-[4-[2-(methanesulfonamido)ethyl]phenyl]-2-phenyl-1H-benzimidazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C=C(C=CC2=N1)C(=O)NC3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)N=C(N5)C)N

DOS

IR

Vibrations