Geometry & MOs

Info

ID:

72038

PubChem CID:

48415742

Reduced:

ON3C20H23 (1)

Stoich.:

AB3C20D23 (1)

Weight, g/mol:

325.15904

ΔHf, kcal/mol:

1.01

Dipole, Da:

4.75

IP(EA), eV:

-9.09(-0.27)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-2-(2-fluorophenyl)-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)N(C)CCCC2=NC3=CC=CC=C3N2)C

DOS

IR

Vibrations