Geometry & MOs

Info

ID:	69345
PubChem CID:	46530769
Reduced:	SN2F3O3C17H21 (1)
Stoich.:	AB2C3D3E17F21 (1)
Weight, g/mol:	363.086447
ΔH_f, kcal/mol:	-285.84
Dipole, Da:	5.89
IP(EA), eV:	-8.85(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,2-dioxo-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazin-9-yl)-[3-(trifluoromethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)N3CCCC(C3)C(F)(F)F

DOS

IR

Vibrations