Geometry & MOs

Info

ID:	220962
PubChem CID:	85248003
Reduced:	O3C15H20 (1)
Stoich.:	A3B15C20 (1)
Weight, g/mol:	248.17763
ΔH_f, kcal/mol:	-107.7
Dipole, Da:	5.51
IP(EA), eV:	-10.07(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-hex-3-enylbicyclo[3.2.1]oct-2-ene-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C2C(=O)OC3C2(C4(C(C1)O4)C(CC3)(C)C)C

DOS

IR

Vibrations