Geometry & MOs

Info

ID:	352460
PubChem CID:	127283548
Reduced:	NSO5C16H19 (1)
Stoich.:	ABC5D16E19 (1)
Weight, g/mol:	308.083078
ΔH_f, kcal/mol:	-161.54
Dipole, Da:	5.62
IP(EA), eV:	-8.61(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-oxo-2-(1-oxo-1,4-thiazinan-4-yl)ethyl]-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

C1CS(=O)CCN1C(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations