Geometry & MOs

Info

ID:	344777
PubChem CID:	127268365
Reduced:	N2S3O4C15H20 (1)
Stoich.:	A2B3C4D15E20 (1)
Weight, g/mol:	374.130028
ΔH_f, kcal/mol:	-132.28
Dipole, Da:	5.37
IP(EA), eV:	-8.79(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-5-ylsulfonyl)-4-methyl-2-phenylpiperazine

Drug info:

PubChemData

Smile

CC(C1=NC2=CC=CC=C2S1)N(C)S(=O)(=O)C3CCS(=O)(=O)CC3

DOS

IR

Vibrations