Geometry & MOs

Info

ID:	199236
PubChem CID:	79221888
Reduced:	N2S2C13H20 (1)
Stoich.:	A2B2C13D20 (1)
Weight, g/mol:	326.094512
ΔH_f, kcal/mol:	21.44
Dipole, Da:	4.36
IP(EA), eV:	-8.6(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylsulfanyl-1-(2-phenylsulfanylethyl)piperidine-4-carbothioamide

Drug info:

PubChemData

Smile

CC(C)N(CCSC1=CC=CC=C1)CC(=S)N

DOS

IR

Vibrations