Geometry & MOs

Info

ID:	257302
PubChem CID:	103145043
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	276.183778
ΔH_f, kcal/mol:	-8.08
Dipole, Da:	7.66
IP(EA), eV:	-8.92(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)NC2CCN(C2)C

DOS

IR

Vibrations