Geometry & MOs

Info

ID:	271555
PubChem CID:	103683487
Reduced:	BrFNSO3C12H13 (1)
Stoich.:	ABCDE3F12G13 (1)
Weight, g/mol:	292.088164
ΔH_f, kcal/mol:	-152.9
Dipole, Da:	4.26
IP(EA), eV:	-10.1(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-indol-5-yl-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

CC1CS(=O)(=O)CCN1C(=O)C2=C(C=CC(=C2)F)Br

DOS

IR

Vibrations