Geometry & MOs

Info

ID:	366322
PubChem CID:	127319787
Reduced:	S2O3N4C12H14 (1)
Stoich.:	A2B3C4D12E14 (1)
Weight, g/mol:	362.060425
ΔH_f, kcal/mol:	-41.73
Dipole, Da:	8.06
IP(EA), eV:	-9.31(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-oxoethyl]-4H-1,4-benzothiazin-3-one

Drug info:

PubChemData

Smile

C1CN2C=CN=C2CN1C(=O)CNS(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations