Geometry & MOs

Info

ID:	81313
PubChem CID:	49854590
Reduced:	ClSN3O5C26H28 (1)
Stoich.:	ABC3D5E26F28 (1)
Weight, g/mol:	487.137734
ΔH_f, kcal/mol:	-130.82
Dipole, Da:	6.33
IP(EA), eV:	-8.18(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-[4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4OC

DOS

IR

Vibrations