Geometry & MOs

Info

ID:	81698
PubChem CID:	49855025
Reduced:	ClSN5O5H22C24 (1)
Stoich.:	ABC5D5E22F24 (1)
Weight, g/mol:	503.108183
ΔH_f, kcal/mol:	-21.48
Dipole, Da:	2.7
IP(EA), eV:	-8.07(-2.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-3-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]benzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C5=NON=C45)Cl

DOS

IR

Vibrations