Geometry & MOs

Info

ID:	352444
PubChem CID:	127283532
Reduced:	N2S3O4C14H20 (1)
Stoich.:	A2B3C4D14E20 (1)
Weight, g/mol:	227.098
ΔH_f, kcal/mol:	-123.93
Dipole, Da:	5.77
IP(EA), eV:	-8.9(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohex-3-en-1-yl-(1-oxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CC(=O)N3CCS(=O)CC3

DOS

IR

Vibrations