Geometry & MOs

Info

ID:	303776
PubChem CID:	124490164
Reduced:	NSO2H13C15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	271.0667
ΔH_f, kcal/mol:	-31.36
Dipole, Da:	4.35
IP(EA), eV:	-8.8(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-hydroxy-2-phenyl-3H-1,4-benzothiazine-4-carbaldehyde

Drug info:

PubChemData

Smile

C1[C@](SC2=CC=CC=C2N1C=O)(C3=CC=CC=C3)O

DOS

IR

Vibrations