Geometry & MOs

Info

ID:	340317
PubChem CID:	127262328
Reduced:	O2C15H20 (1)
Stoich.:	A2B15C20 (1)
Weight, g/mol:	246.125594
ΔH_f, kcal/mol:	-73.05
Dipole, Da:	2.7
IP(EA), eV:	-9.23(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z,9E)-3,10-dimethyl-4,7,8,11-tetrahydrocyclodeca[b]furan-6-carboxylic acid

Drug info:

PubChemData

Smile

CC1CC/C=C(/CC2=C(C(=CO2)C)C(=O)C1)\C

DOS

IR

Vibrations