Geometry & MOs

Info

ID:	276423
PubChem CID:	103823205
Reduced:	O4N5C12H15 (1)
Stoich.:	A4B5C12D15 (1)
Weight, g/mol:	269.148789
ΔH_f, kcal/mol:	14.18
Dipole, Da:	14.01
IP(EA), eV:	-9.22(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2,5-dimethyl-4-nitropyrazol-3-yl)amino]-N,2,2-trimethylpropanamide

Drug info:

PubChemData

Smile

CC(C)(CNC1=CC=C(C2=NON=C12)[N+](=O)[O-])C(=O)NC

DOS

IR

Vibrations