Geometry & MOs

Info

ID:	36384
PubChem CID:	8004859
Reduced:	OF2N2S2H12C16 (1)
Stoich.:	AB2C2D2E12F16 (1)
Weight, g/mol:	362.031433
ΔH_f, kcal/mol:	-61.6
Dipole, Da:	3.75
IP(EA), eV:	-9.04(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-[(2-chlorophenyl)methyl]acetamide

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2N=C(S1)SCC(=O)NC3=C(C=C(C=C3)F)F

DOS

IR

Vibrations