Geometry & MOs

Info

ID:	248256
PubChem CID:	103080063
Reduced:	ON2C7H12 (2)
Stoich.:	AB2C7D12 (2)
Weight, g/mol:	255.133139
ΔH_f, kcal/mol:	-15.36
Dipole, Da:	6.56
IP(EA), eV:	-8.8(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-methyl-4-nitropyrazol-3-yl)amino]-N-propan-2-ylpropanamide

Drug info:

PubChemData

Smile

CC1(CC(CC(C1)(C)C)NC2=NN(C=C2[N+](=O)[O-])C)C

DOS

IR

Vibrations