Geometry & MOs

Info

ID:	437067
PubChem CID:	135214433
Reduced:	SC11H12 (1)
Stoich.:	AB11C12 (1)
Weight, g/mol:	220.109944
ΔH_f, kcal/mol:	30.98
Dipole, Da:	1.92
IP(EA), eV:	-8.33(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,6S)-6-hydroxy-3-tricyclo[6.2.1.02,7]undeca-4,9-dienyl] acetate

Drug info:

PubChemData

Smile

CC1C2(CC2)C3=CC=CC=C3S1

DOS

IR

Vibrations