Geometry & MOs

Info

ID:	431775
PubChem CID:	135171881
Reduced:	N3O4C20H29 (1)
Stoich.:	A3B4C20D29 (1)
Weight, g/mol:	276.183778
ΔH_f, kcal/mol:	-34.37
Dipole, Da:	3.13
IP(EA), eV:	-8.5(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-(2-methylpropyl)-2-nitroaniline

Drug info:

PubChemData

Smile

CC(C)CN(C1CCCCC1)C2=C(C=C(C=C2)C(C)CC(=O)N=O)[N+](=O)[O-]

DOS

IR

Vibrations