Geometry & MOs

Info

ID:	352734
PubChem CID:	127283823
Reduced:	SN2O4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	337.109627
ΔH_f, kcal/mol:	-112.82
Dipole, Da:	5.81
IP(EA), eV:	-8.62(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dimethoxy-2-[(1-oxo-1,4-thiazinan-4-yl)methyl]-1H-quinazolin-4-one

Drug info:

PubChemData

Smile

C1CS(=O)CCN1CC(=O)NCC2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations