Geometry & MOs

Info

ID:

328651

PubChem CID:

126726282

Reduced:

O2N3C27H27 (1)

Stoich.:

A2B3C27D27 (1)

Weight, g/mol:

469.236542

ΔHf, kcal/mol:

9.22

Dipole, Da:

2.5

IP(EA), eV:

-9.22(-0.63)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-ethyl-N-(4-hydroxycyclohexyl)-2-[hydroxy(diphenyl)methyl]benzimidazole-5-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=CC(=C2)C(=O)NC3CCC3)N=C1C(C4=CC=CC=C4)(C5=CC=CC=C5)O

DOS

IR

Vibrations