Geometry & MOs

Info

ID:	248206
PubChem CID:	103079685
Reduced:	ON2C5H8 (2)
Stoich.:	AB2C5D8 (2)
Weight, g/mol:	239.101839
ΔH_f, kcal/mol:	14.58
Dipole, Da:	6.37
IP(EA), eV:	-8.85(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[(1-methyl-4-nitropyrazol-3-yl)amino]acetamide

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)NCC2CCCC2)[N+](=O)[O-]

DOS

IR

Vibrations