Geometry & MOs

Info

ID:	376514
PubChem CID:	134222531
Reduced:	NO2C8H12 (2)
Stoich.:	AB2C8D12 (2)
Weight, g/mol:	248.225249
ΔH_f, kcal/mol:	-37.27
Dipole, Da:	5.9
IP(EA), eV:	-10.91(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-decylbenzene-1,3-diamine

Drug info:

PubChemData

Smile

CCCCCCCCCCC1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations