Geometry & MOs

Info

ID:	9050
PubChem CID:	85629
Reduced:	NO2C12H25 (1)
Stoich.:	AB2C12D25 (1)
Weight, g/mol:	215.188529
ΔH_f, kcal/mol:	-69.71
Dipole, Da:	4.18
IP(EA), eV:	-10.6(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-nitrododecane

Drug info:

PubChemData

Smile

CCCCCCCCCCCC[N+](=O)[O-]

DOS

IR

Vibrations