Geometry & MOs

Info

ID:	23662
PubChem CID:	605348
Reduced:	NO2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	207.125929
ΔH_f, kcal/mol:	-14.09
Dipole, Da:	5.01
IP(EA), eV:	-10.14(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hexyl-2-nitrobenzene

Drug info:

PubChemData

Smile

CCCCCCC1=CC=CC=C1[N+](=O)[O-]

DOS

IR

Vibrations