Geometry & MOs

Info

ID:	136257
PubChem CID:	52008919
Reduced:	SN2O3C17H18 (1)
Stoich.:	AB2C3D17E18 (1)
Weight, g/mol:	332.06532
ΔH_f, kcal/mol:	-89.84
Dipole, Da:	5.16
IP(EA), eV:	-8.84(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methyl-3-oxo-N-(2-thiophen-2-ylethyl)-4H-1,4-benzothiazine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CCNC(=O)[C@]2(C(=O)NC3=CC=CC=C3S2)C

DOS

IR

Vibrations