Geometry & MOs

Info

ID:	251412
PubChem CID:	103103772
Reduced:	N3O4C9H17 (1)
Stoich.:	A3B4C9D17 (1)
Weight, g/mol:	246.111676
ΔH_f, kcal/mol:	-186.77
Dipole, Da:	4.48
IP(EA), eV:	-9.74(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-N-ethyl-3H-benzimidazole-5-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)NCC(=O)OCC

DOS

IR

Vibrations