Geometry & MOs

Info

ID:	248264
PubChem CID:	103080115
Reduced:	O2N4C9H12 (1)
Stoich.:	A2B4C9D12 (1)
Weight, g/mol:	224.127326
ΔH_f, kcal/mol:	62.28
Dipole, Da:	6.94
IP(EA), eV:	-8.98(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclobutylethyl)-1-methyl-4-nitropyrazol-3-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations