Geometry & MOs

Info

ID:	352446
PubChem CID:	127283534
Reduced:	SN2O3C14H18 (1)
Stoich.:	AB2C3D14E18 (1)
Weight, g/mol:	227.061614
ΔH_f, kcal/mol:	-102.81
Dipole, Da:	3.92
IP(EA), eV:	-8.56(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methylfuran-2-yl)-(1-oxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C(=O)CCC2)C(=O)N3CCS(=O)CC3

DOS

IR

Vibrations