Geometry & MOs

Info

ID:	7099
PubChem CID:	71209
Reduced:	NSCl2O3C11H11 (1)
Stoich.:	ABC2D3E11F11 (1)
Weight, g/mol:	306.98367
ΔH_f, kcal/mol:	-108.62
Dipole, Da:	4.23
IP(EA), eV:	-9.64(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dichlorophenyl)-3-methyl-1,1-dioxo-1,3-thiazinan-4-one

Drug info:

PubChemData

Smile

CN1C(S(=O)(=O)CCC1=O)C2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations