Geometry & MOs

Info

ID:	13774
PubChem CID:	398015
Reduced:	NSO3H15C23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	385.077265
ΔH_f, kcal/mol:	7.75
Dipole, Da:	5.14
IP(EA), eV:	-9.09(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-hydroxy-3-oxo-1,3-diphenylprop-1-en-2-yl)-1,4-benzothiazin-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=C(C2=NC3=CC=CC=C3SC2=O)C(=O)C4=CC=CC=C4)O

DOS

IR

Vibrations