Geometry & MOs

Info

ID:	23994
PubChem CID:	607357
Reduced:	N4O4C11H16 (1)
Stoich.:	A4B4C11D16 (1)
Weight, g/mol:	268.117155
ΔH_f, kcal/mol:	-3.9
Dipole, Da:	5.17
IP(EA), eV:	-9.5(-2.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2,5-dinitrophenyl)pentane-1,5-diamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1[N+](=O)[O-])NCCCCCN)[N+](=O)[O-]

DOS

IR

Vibrations