Geometry & MOs

Info

ID:	190200
PubChem CID:	77967120
Reduced:	IH23C25 (1)
Stoich.:	AB23C25 (1)
Weight, g/mol:	464.1001
ΔH_f, kcal/mol:	70.57
Dipole, Da:	1.84
IP(EA), eV:	-8.73(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-iodo-9,9-dimethyl-7-[1-(2-methylphenyl)but-1-en-2-yl]fluorene

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C=C(C)C2=CC3=C(C=C2)C4=C(C3(C)C)C=C(C=C4)I

DOS

IR

Vibrations