Geometry & MOs

Info

ID:	352454
PubChem CID:	127283542
Reduced:	NSO3C10H13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	243.1293
ΔH_f, kcal/mol:	-82.99
Dipole, Da:	4.96
IP(EA), eV:	-8.57(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-1-(1-oxo-1,4-thiazinan-4-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(=O)N2CCS(=O)CC2

DOS

IR

Vibrations