Geometry & MOs

Info

ID:	50182
PubChem CID:	12012692
Reduced:	NSBr2O3C15H15 (1)
Stoich.:	ABC2D3E15F15 (1)
Weight, g/mol:	392.975998
ΔH_f, kcal/mol:	-74.18
Dipole, Da:	8.07
IP(EA), eV:	-10.24(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-4-methyl-N-(3,5,6-trichloro-5,6-dimethyl-4-oxocyclohex-2-en-1-ylidene)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)/N=C/2\C(C(C(=O)C(=C2C)C)Br)Br

DOS

IR

Vibrations