Geometry & MOs

Info

ID:	248261
PubChem CID:	103080106
Reduced:	O2N4C9H16 (1)
Stoich.:	A2B4C9D16 (1)
Weight, g/mol:	208.096026
ΔH_f, kcal/mol:	4.5
Dipole, Da:	6.55
IP(EA), eV:	-8.76(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopent-3-en-1-yl-1-methyl-4-nitropyrazol-3-amine

Drug info:

PubChemData

Smile

CCC(C)(C)NC1=NN(C=C1[N+](=O)[O-])C

DOS

IR

Vibrations