Geometry & MOs

Info

ID:	314527
PubChem CID:	126622041
Reduced:	SN3O3C15H17 (1)
Stoich.:	AB3C3D15E17 (1)
Weight, g/mol:	417.172228
ΔH_f, kcal/mol:	-65.71
Dipole, Da:	6.24
IP(EA), eV:	-8.9(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[4-(phenylsulfamoyl)phenyl]piperazine-1-carboxylate

Drug info:

PubChemData

Smile

C1CN(CCN1)C2=CC=C(C=C2)S(=O)(=O)C3=CC(=O)NC=C3

DOS

IR

Vibrations