Geometry & MOs

Info

ID:	22700
PubChem CID:	598382
Reduced:	ClNO2H5C7 (2)
Stoich.:	ABC2D5E7 (2)
Weight, g/mol:	340.001762
ΔH_f, kcal/mol:	10.88
Dipole, Da:	0.1
IP(EA), eV:	-9.95(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-2-[2-(2-chloro-6-nitrophenyl)ethyl]-3-nitrobenzene

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)CCC2=C(C=CC=C2Cl)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations