Geometry & MOs

Info

ID:	13773
PubChem CID:	398013
Reduced:	NSO3H15C23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	385.077265
ΔH_f, kcal/mol:	-10.45
Dipole, Da:	3.08
IP(EA), eV:	-8.61(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-oxo-4H-1,4-benzothiazin-2-ylidene)-1,3-diphenylpropane-1,3-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C(=C2C(=O)NC3=CC=CC=C3S2)C(=O)C4=CC=CC=C4

DOS

IR

Vibrations