Geometry & MOs

Info

ID:	248247
PubChem CID:	103080001
Reduced:	O2N6C11H16 (1)
Stoich.:	A2B6C11D16 (1)
Weight, g/mol:	252.158626
ΔH_f, kcal/mol:	55.5
Dipole, Da:	6.39
IP(EA), eV:	-8.72(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-nitro-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrazol-3-amine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)CNC2=NN(C=C2[N+](=O)[O-])C

DOS

IR

Vibrations