Geometry & MOs

Info

ID:	11000
PubChem CID:	109782
Reduced:	ClN5O5C21H26 (1)
Stoich.:	AB5C5D21E26 (1)
Weight, g/mol:	463.162247
ΔH_f, kcal/mol:	-76.65
Dipole, Da:	10.42
IP(EA), eV:	-8.59(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxyethyl N-[2-[(2-chloro-4-nitrophenyl)diazenyl]-5-(diethylamino)phenyl]carbamate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations