Geometry & MOs

Info

ID:	22020
PubChem CID:	595275
Reduced:	O2C17H26 (1)
Stoich.:	A2B17C26 (1)
Weight, g/mol:	262.19328
ΔH_f, kcal/mol:	-126.2
Dipole, Da:	2.45
IP(EA), eV:	-8.72(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,4,8-trimethyl-9-tricyclo[6.3.1.01,5]dodec-3-enyl) acetate

Drug info:

PubChemData

Smile

CC1=C(C2CCC3(CC2(C1)CCC3OC(=O)C)C)C

DOS

IR

Vibrations