Geometry & MOs

Info

ID:	257314
PubChem CID:	103145122
Reduced:	N2O4C15H16 (1)
Stoich.:	A2B4C15D16 (1)
Weight, g/mol:	262.168128
ΔH_f, kcal/mol:	-63.81
Dipole, Da:	4.62
IP(EA), eV:	-8.98(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethylcyclopentyl)-2,5-dimethyl-4-nitroaniline

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)NCC2=C(C(=CC=C2)O)O

DOS

IR

Vibrations