Geometry & MOs

Info

ID:	79205
PubChem CID:	49747411
Reduced:	SN4O5C28H34 (1)
Stoich.:	AB4C5D28E34 (1)
Weight, g/mol:	409.112999
ΔH_f, kcal/mol:	-188.59
Dipole, Da:	3.43
IP(EA), eV:	-8.37(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2-oxo-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1C2=CC(=CC3=C2N(C1=O)CCC3)NC(=O)C(=O)NCCC4CCCCN4S(=O)(=O)C5=CC=C(C=C5)C

DOS

IR

Vibrations