Geometry & MOs

Info

ID:	29362
PubChem CID:	833369
Reduced:	OSCl2N2H12C15 (1)
Stoich.:	ABC2D2E12F15 (1)
Weight, g/mol:	276.129634
ΔH_f, kcal/mol:	-4.47
Dipole, Da:	7.04
IP(EA), eV:	-8.97(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(4-methylpiperidine-1-carbothioyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations