Geometry & MOs

Info

ID:	81223
PubChem CID:	49854480
Reduced:	O2N3C20H23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	485.117605
ΔH_f, kcal/mol:	-65.52
Dipole, Da:	3.4
IP(EA), eV:	-8.52(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-methoxy-N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)NC1=CC=C(C=C1)CC2C3=CC=CC=C3NC2=O

DOS

IR

Vibrations