Geometry & MOs

Info

ID:	344985
PubChem CID:	127268745
Reduced:	N2S3O4C14H22 (1)
Stoich.:	A2B3C4D14E22 (1)
Weight, g/mol:	380.086449
ΔH_f, kcal/mol:	-143.78
Dipole, Da:	6.97
IP(EA), eV:	-8.96(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-5-sulfonamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CCC1S(=O)(=O)NCCN2CCC3=C(C2)C=CS3

DOS

IR

Vibrations