Geometry & MOs

Info

ID:

207238

PubChem CID:

80364265

Reduced:

N2Cl3C15H17 (1)

Stoich.:

A2B3C15D17 (1)

Weight, g/mol:

318.045732

ΔHf, kcal/mol:

18.55

Dipole, Da:

5.63

IP(EA), eV:

-9.13(-0.93)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5,6-dichloro-2-(chloromethyl)-1-(2,3-dimethylbutyl)benzimidazole

Drug info:

PubChemData

Smile

CCC(CC1CC1)N2C3=CC(=C(C=C3N=C2CCl)Cl)Cl

DOS

IR

Vibrations