Geometry & MOs

Info

ID:	409522
PubChem CID:	135082304
Reduced:	CH (16)
Stoich.:	AB (16)
Weight, g/mol:	168.106788
ΔH_f, kcal/mol:	121.49
Dipole, Da:	0.03
IP(EA), eV:	-8.04(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,3S,5R)-4,4,4-trimethyl-4lambda5-phosphatetracyclo[3.3.0.02,8.03,6]octane

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C#CC3=C(CCCC3)C#C2

DOS

IR

Vibrations