Geometry & MOs

Info

ID:	132896
PubChem CID:	51442797
Reduced:	SN3O6C16H19 (1)
Stoich.:	AB3C6D16E19 (1)
Weight, g/mol:	386.093643
ΔH_f, kcal/mol:	-237.88
Dipole, Da:	4.2
IP(EA), eV:	-9.16(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-methoxyanilino)-2-oxoethyl] (2S)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxylate

Drug info:

PubChemData

Smile

C[C@H]1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCC(=O)NC(=O)NCCOC

DOS

IR

Vibrations