Geometry & MOs

Info

ID:	358641
PubChem CID:	127296420
Reduced:	S2N4O4C11H18 (1)
Stoich.:	A2B4C4D11E18 (1)
Weight, g/mol:	257.14495
ΔH_f, kcal/mol:	-122.35
Dipole, Da:	7.67
IP(EA), eV:	-8.6(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NCC(=O)N2CCS(=O)CC2

DOS

IR

Vibrations