Geometry & MOs

Info

ID:	274809
PubChem CID:	103811798
Reduced:	OSN2C12H26 (1)
Stoich.:	ABC2D12E26 (1)
Weight, g/mol:	230.145285
ΔH_f, kcal/mol:	-91.07
Dipole, Da:	1.73
IP(EA), eV:	-8.48(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(4-methylsulfanylbutan-2-yl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CCSCCC(C)NC(=O)[C@H](CC(C)C)N

DOS

IR

Vibrations