Geometry & MOs

Info

ID:	290270
PubChem CID:	104426104
Reduced:	ON4C11H20 (1)
Stoich.:	AB4C11D20 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-37.47
Dipole, Da:	3.97
IP(EA), eV:	-8.63(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-methyl-2-nitroanilino)-N-(2-methylpropyl)propanamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)CCNC1=NC=CN1C

DOS

IR

Vibrations