Geometry & MOs

Info

ID:	363700
PubChem CID:	127313318
Reduced:	SO3N4C19H28 (1)
Stoich.:	AB3C4D19E28 (1)
Weight, g/mol:	365.177313
ΔH_f, kcal/mol:	-111.3
Dipole, Da:	3.48
IP(EA), eV:	-9.02(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(2-methylpropanoyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CC(=O)NCC1=CC=CS1)C(=O)C2CCCN(C2)C(=O)N3CCCC3

DOS

IR

Vibrations