Geometry & MOs

Info

ID:	409097
PubChem CID:	135081873
Reduced:	Cl4N6O8H10C15 (1)
Stoich.:	A4B6C8D10E15 (1)
Weight, g/mol:	533.111375
ΔH_f, kcal/mol:	20.08
Dipole, Da:	6.25
IP(EA), eV:	-10.18(-2.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-fluoro-2,2-dinitroethyl)-N-[8-[nitro(2,2,2-trinitroethyl)amino]octyl]nitramide

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1[N+](=O)[O-])N(CCCN(C2=C(C=C(C=C2Cl)Cl)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])Cl)Cl

DOS

IR

Vibrations