Geometry & MOs

Info

ID:	210232
PubChem CID:	80778395
Reduced:	N4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	271.132077
ΔH_f, kcal/mol:	61.66
Dipole, Da:	3.45
IP(EA), eV:	-8.4(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-methyl-2-nitro-3-N-(2-phenylethyl)benzene-1,3-diamine

Drug info:

PubChemData

Smile

CNC1=CN=CC(=N1)NCCC2=CC=CC=C2

DOS

IR

Vibrations