Geometry & MOs

Info

ID:	394616
PubChem CID:	135023290
Reduced:	O2C17H20 (1)
Stoich.:	A2B17C20 (1)
Weight, g/mol:	320.17763
ΔH_f, kcal/mol:	-34.71
Dipole, Da:	2.11
IP(EA), eV:	-9.5(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,6aR)-3-pent-4-enyl-4-(4-phenylbut-1-ynyl)-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one

Drug info:

PubChemData

Smile

CC(=O)O[C@H](CCC=C)C#CCCC1=CC=CC=C1

DOS

IR

Vibrations