Geometry & MOs

Info

ID:	24670
PubChem CID:	612109
Reduced:	OH4C5 (4)
Stoich.:	AB4C5 (4)
Weight, g/mol:	320.104859
ΔH_f, kcal/mol:	-108.55
Dipole, Da:	4.92
IP(EA), eV:	-9.57(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,8-dimethyltetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13,15-heptaene-15,16-dicarboxylic acid

Drug info:

PubChemData

Smile

CC12C3=CC=CC=C3C(C4=CC=CC=C41)(C(=C2C(=O)O)C(=O)O)C

DOS

IR

Vibrations