Geometry & MOs

Info

ID:	159815
PubChem CID:	57288779
Reduced:	O2C15H18 (1)
Stoich.:	A2B15C18 (1)
Weight, g/mol:	434.19844
ΔH_f, kcal/mol:	-57.8
Dipole, Da:	5.5
IP(EA), eV:	-9.42(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-2-fluoro-4-[1-[4-(4-pentylcyclohexyl)cyclohexylidene]ethyl]benzene

Drug info:

PubChemData

Smile

CC(C)(C)C=C(C=CC1=CC=CC=C1)C(=O)O

DOS

IR

Vibrations