Geometry & MOs

Info

ID:	29956
PubChem CID:	838495
Reduced:	N2O4C9H10 (1)
Stoich.:	A2B4C9D10 (1)
Weight, g/mol:	205.085127
ΔH_f, kcal/mol:	-115.01
Dipole, Da:	4.02
IP(EA), eV:	-8.94(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-nitro-2-propyl-1H-benzimidazole

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C=NNC(=O)CO)O)O

DOS

IR

Vibrations