Geometry & MOs

Info

ID:	124729
PubChem CID:	50894221
Reduced:	SCl2N2O5H12C15 (1)
Stoich.:	AB2C2D5E12F15 (1)
Weight, g/mol:	414.003698
ΔH_f, kcal/mol:	-85.23
Dipole, Da:	2.56
IP(EA), eV:	-10.23(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-5-nitro-N-(2-nitrophenyl)sulfonylanilino)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations