Geometry & MOs

Info

ID:	399409
PubChem CID:	135040145
Reduced:	SO2H8C11 (1)
Stoich.:	AB2C8D11 (1)
Weight, g/mol:	274.229666
ΔH_f, kcal/mol:	-7.62
Dipole, Da:	1.31
IP(EA), eV:	-9.12(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R,10R)-10-methoxy-4-oct-1-ynylspiro[4.5]dec-3-ene

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C2=CC(=O)C=CC2=O

DOS

IR

Vibrations