Geometry & MOs

Info

ID:	14145
PubChem CID:	405115
Reduced:	OC10H15 (2)
Stoich.:	AB10C15 (2)
Weight, g/mol:	302.22458
ΔH_f, kcal/mol:	-60.69
Dipole, Da:	4.99
IP(EA), eV:	-9.32(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3R,14R)-6,10,14-trimethyl-3-prop-1-en-2-yl-15-oxabicyclo[12.1.0]pentadeca-6,10-dien-5-one

Drug info:

PubChemData

Smile

CC1=CCC[C@@]2([C@H](O2)C[C@H](CC(=O)C(=CCC1)C)C(=C)C)C

DOS

IR

Vibrations