Geometry & MOs

Info

ID:	269584
PubChem CID:	103618049
Reduced:	SN2O2C11H12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	266.108899
ΔH_f, kcal/mol:	-39.32
Dipole, Da:	5.25
IP(EA), eV:	-8.86(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-ethylthiophen-2-yl)methyl]-6-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCOCC(=O)NC1=CC2=C(C=C1)N=CS2

DOS

IR

Vibrations