Geometry & MOs

Info

ID:	9507
PubChem CID:	90383
Reduced:	O5N7C19H19 (1)
Stoich.:	A5B7C19D19 (1)
Weight, g/mol:	425.144767
ΔH_f, kcal/mol:	53.73
Dipole, Da:	11.23
IP(EA), eV:	-8.84(-2.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-cyano-4,6-dinitrophenyl)diazenyl]-5-(diethylamino)phenyl]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C#N)NC(=O)C

DOS

IR

Vibrations