Geometry & MOs

Info

ID:

313635

PubChem CID:

126616764

Reduced:

O2N3C25H33 (1)

Stoich.:

A2B3C25D33 (1)

Weight, g/mol:

635.150925

ΔHf, kcal/mol:

-72.58

Dipole, Da:

4.08

IP(EA), eV:

 -9.42(-0.93)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[[4-[6-[bis(4-chlorophenyl)methyl]-2-cyclopropylbenzimidazol-1-yl]piperidin-1-yl]methyl]furan-2-carboxylic acid;hydrochloride

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@H]([C@@H](C1)C(=O)NC[C@H](C2=CC=CC=C2)NC(=O)C3=CC=CC=N3)C(C)C

DOS

IR

Vibrations