Geometry & MOs

Info

ID:	404710
PubChem CID:	135069816
Reduced:	O4C17H24 (1)
Stoich.:	A4B17C24 (1)
Weight, g/mol:	312.136159
ΔH_f, kcal/mol:	-111.24
Dipole, Da:	1.79
IP(EA), eV:	-7.97(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl tetracyclo[7.6.0.01,13.02,7]pentadeca-2,4,6,8-tetraene-11,11-dicarboxylate

Drug info:

PubChemData

Smile

CCC/C=C/C1=C2CCC2CC(C1)(C(=O)OC)C(=O)OC

DOS

IR

Vibrations