Geometry & MOs

Info

ID:	401533
PubChem CID:	135051535
Reduced:	ClS2O4C13H13 (1)
Stoich.:	AB2C4D13E13 (1)
Weight, g/mol:	525.74242
ΔH_f, kcal/mol:	33.93
Dipole, Da:	11.32
IP(EA), eV:	-10.06(-3.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,3,3-tetrabromo-1,3-diphenylpropan-2-one

Drug info:

PubChemData

Smile

C1CCC2=S(SC(=C2C1)C3=CC=CC=C3)OCl(=O)(=O)=O

DOS

IR

Vibrations