Geometry & MOs

Info

ID:	352859
PubChem CID:	127283949
Reduced:	SN3O3C17H27 (1)
Stoich.:	AB3C3D17E27 (1)
Weight, g/mol:	285.085721
ΔH_f, kcal/mol:	-111.56
Dipole, Da:	2.52
IP(EA), eV:	-8.36(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclohexylsulfonyl-6,7-dihydro-4H-thieno[3,2-c]pyridine

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)CC3CCCO3

DOS

IR

Vibrations