Geometry & MOs

Info

ID:	210540
PubChem CID:	80819502
Reduced:	O2N4C11H18 (1)
Stoich.:	A2B4C11D18 (1)
Weight, g/mol:	280.153541
ΔH_f, kcal/mol:	7.49
Dipole, Da:	9.03
IP(EA), eV:	-8.52(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-[3-nitro-5-(propylamino)anilino]propanamide

Drug info:

PubChemData

Smile

CC(CNC1=CC(=CC(=C1)N)[N+](=O)[O-])N(C)C

DOS

IR

Vibrations