Geometry & MOs

Info

ID:	229990
PubChem CID:	87569830
Reduced:	IO2C6H9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	598.381081
ΔH_f, kcal/mol:	-150.07
Dipole, Da:	3.05
IP(EA), eV:	-9.57(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[7-(4-formylphenyl)-9,9-dioctylfluoren-2-yl]benzaldehyde

Drug info:

PubChemData

Smile

C(CCCC(I)I)CCCOC(=O)/C=C/C(=O)O

DOS

IR

Vibrations