Geometry & MOs

Info

ID:	157950
PubChem CID:	56459339
Reduced:	F2O2N4C21H22 (1)
Stoich.:	A2B2C4D21E22 (1)
Weight, g/mol:	372.176168
ΔH_f, kcal/mol:	-106.13
Dipole, Da:	4.13
IP(EA), eV:	-8.78(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(difluoromethyl)-N-[2-(N-ethyl-3-methylanilino)ethyl]-3H-benzimidazole-5-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)N=C(N4)C(F)F

DOS

IR

Vibrations