Geometry & MOs

Info

ID:	371556
PubChem CID:	127347143
Reduced:	OF4N5C18H19 (1)
Stoich.:	AB4C5D18E19 (1)
Weight, g/mol:	272.155849
ΔH_f, kcal/mol:	-173.78
Dipole, Da:	10.02
IP(EA), eV:	-9.38(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-1-oxo-1,4-thiazinan-4-yl)-1-(4-methylpiperidin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)N2CCCC(C2=O)N3CCN4C(=NN=C4C(F)(F)F)C3

DOS

IR

Vibrations