Geometry & MOs

Info

ID:	279206
PubChem CID:	103842043
Reduced:	BrClON2H12C13 (1)
Stoich.:	ABCD2E12F13 (1)
Weight, g/mol:	364.9488
ΔH_f, kcal/mol:	27.46
Dipole, Da:	2.1
IP(EA), eV:	-9.94(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-4-chlorophenyl)-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

C1CC1N(CCC#N)C(=O)C2=CC(=C(C=C2)Cl)Br

DOS

IR

Vibrations