Geometry & MOs

Info

ID:	408216
PubChem CID:	135080977
Reduced:	HLiSC3 (2)
Stoich.:	ABCD3 (2)
Weight, g/mol:	152.08373
ΔH_f, kcal/mol:	99.12
Dipole, Da:	11.37
IP(EA), eV:	-7.26(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z,8R)-9-oxabicyclo[6.2.0]dec-4-en-10-one

Drug info:

PubChemData

Smile

[Li+].[Li+].C1=[C-]SC2=C1C=[C-]S2

DOS

IR

Vibrations