Geometry & MOs

Info

ID:	345111
PubChem CID:	127268871
Reduced:	N2S3O5C13H22 (1)
Stoich.:	A2B3C5D13E22 (1)
Weight, g/mol:	386.097014
ΔH_f, kcal/mol:	-191.02
Dipole, Da:	4.92
IP(EA), eV:	-9.09(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dihydro-1,4-benzodioxin-5-ylsulfonyl)-N-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CN(C1CC1)C(=O)C2CSCN2S(=O)(=O)C3CCS(=O)(=O)CC3

DOS

IR

Vibrations