Geometry & MOs

Info

ID:	352740
PubChem CID:	127283829
Reduced:	SO2N4C17H22 (1)
Stoich.:	AB2C4D17E22 (1)
Weight, g/mol:	297.060569
ΔH_f, kcal/mol:	-12.01
Dipole, Da:	3.82
IP(EA), eV:	-8.6(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-7-[(1-oxo-1,4-thiazinan-4-yl)methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CN3CCS(=O)CC3

DOS

IR

Vibrations