Geometry & MOs

Info

ID:	362775
PubChem CID:	127309323
Reduced:	SN2O2C13H24 (1)
Stoich.:	AB2C2D13E24 (1)
Weight, g/mol:	254.145285
ΔH_f, kcal/mol:	-119.12
Dipole, Da:	2.33
IP(EA), eV:	-8.74(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethenyl-N-(thian-4-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1CN(CC(O1)C)C(=O)NC2CCSCC2

DOS

IR

Vibrations