Geometry & MOs

Info

ID:	257317
PubChem CID:	103145145
Reduced:	O2N4C15H20 (1)
Stoich.:	A2B4C15D20 (1)
Weight, g/mol:	284.152478
ΔH_f, kcal/mol:	27.25
Dipole, Da:	8.86
IP(EA), eV:	-9.1(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-N-[1-(3-methylphenyl)ethyl]-4-nitroaniline

Drug info:

PubChemData

Smile

CCCN1C(=CC=N1)CNC2=C(C=C(C(=C2)C)[N+](=O)[O-])C

DOS

IR

Vibrations