Geometry & MOs

Info

ID:	731
PubChem CID:	3276
Reduced:	N4O4C7H10 (1)
Stoich.:	A4B4C7D10 (1)
Weight, g/mol:	214.070205
ΔH_f, kcal/mol:	-50.62
Dipole, Da:	4.82
IP(EA), eV:	-10.4(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-2-(2-nitroimidazol-1-yl)acetamide

Drug info:

PubChemData

Smile

C1=CN(C(=N1)[N+](=O)[O-])CC(=O)NCCO

DOS

IR

Vibrations