Geometry & MOs

Info

ID:	410604
PubChem CID:	135083404
Reduced:	ClN3O4H5C7 (2)
Stoich.:	AB3C4D5E7 (2)
Weight, g/mol:	287.090606
ΔH_f, kcal/mol:	43.53
Dipole, Da:	7.77
IP(EA), eV:	-10.43(-2.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[4-(4-nitrophenyl)phenyl]nitramide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)[N+](=O)[O-])N(CCN(C2=C(C=C(C=C2)Cl)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations