Geometry & MOs

Info

ID:	81764
PubChem CID:	49855116
Reduced:	ClOSN2F3H12C15 (1)
Stoich.:	ABCD2E3F12G15 (1)
Weight, g/mol:	487.137734
ΔH_f, kcal/mol:	-159.76
Dipole, Da:	2.67
IP(EA), eV:	-8.8(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-difluorophenyl)-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=S)NC2=CC(=C(C=C2)Cl)C(F)(F)F)O

DOS

IR

Vibrations