Geometry & MOs

Info

ID:	617
PubChem CID:	3090
Reduced:	O2N3C5H7 (1)
Stoich.:	A2B3C5D7 (1)
Weight, g/mol:	141.053826
ΔH_f, kcal/mol:	18.98
Dipole, Da:	5.86
IP(EA), eV:	-10.12(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dimethyl-5-nitroimidazole

Drug info:

PubChemData

Smile

CC1=NC=C(N1C)[N+](=O)[O-]

DOS

IR

Vibrations