Geometry & MOs

Info

ID:	20942
PubChem CID:	586334
Reduced:	OC8H13 (2)
Stoich.:	AB8C13 (2)
Weight, g/mol:	250.19328
ΔH_f, kcal/mol:	-121.87
Dipole, Da:	2.52
IP(EA), eV:	-9.78(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalene-1-carboxylate

Drug info:

PubChemData

Smile

CC1(CCCC2(C1CCC(=C)C2C(=O)OC)C)C

DOS

IR

Vibrations