Geometry & MOs

Info

ID:	345077
PubChem CID:	127268837
Reduced:	NSO4C18H19 (1)
Stoich.:	ABC4D18E19 (1)
Weight, g/mol:	385.101765
ΔH_f, kcal/mol:	-104.78
Dipole, Da:	5.96
IP(EA), eV:	-9.09(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[4-(3-methoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]thiane 1,1-dioxide

Drug info:

PubChemData

Smile

C1CN(CC1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3OCCO4

DOS

IR

Vibrations