Geometry & MOs

Info

ID:	449359
PubChem CID:	135297930
Reduced:	O6C33H50 (1)
Stoich.:	A6B33C50 (1)
Weight, g/mol:	576.14254
ΔH_f, kcal/mol:	-284.45
Dipole, Da:	4.26
IP(EA), eV:	-9.03(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2,7-dibromo-9-(2-hexyloctyl)fluoren-9-yl]propan-1-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)CO)OCCOC2=CC=CC=C2)CO

DOS

IR

Vibrations