Geometry & MOs

Info

ID:	390002
PubChem CID:	134996515
Reduced:	OS2C8H14 (1)
Stoich.:	AB2C8D14 (1)
Weight, g/mol:	361.87412
ΔH_f, kcal/mol:	-45.28
Dipole, Da:	2.49
IP(EA), eV:	-8.08(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,8-dibromo-2,7,7-trimethyl-1,4,6-trioxa-5lambda5-phosphaspiro[4.4]non-8-en-3-one

Drug info:

PubChemData

Smile

CC(=C1SC(CS1=O)(C)C)C

DOS

IR

Vibrations