Geometry & MOs

Info

ID:	136256
PubChem CID:	52008918
Reduced:	SN2O3C17H18 (1)
Stoich.:	AB2C3D17E18 (1)
Weight, g/mol:	330.103814
ΔH_f, kcal/mol:	-89.51
Dipole, Da:	4.66
IP(EA), eV:	-8.85(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methyl-N-[2-(5-methylfuran-2-yl)ethyl]-3-oxo-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