Geometry & MOs

Info

ID:	385889
PubChem CID:	134980245
Reduced:	OC7H8 (2)
Stoich.:	AB7C8 (2)
Weight, g/mol:	414.06193
ΔH_f, kcal/mol:	-61.55
Dipole, Da:	1.34
IP(EA), eV:	-9.44(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-1-[(E)-1,3-diphenylprop-2-enyl]naphthalen-2-ol

Drug info:

PubChemData

Smile

COC(=O)[C@@H]1CCC=C[C@H]1C2=CC=CC=C2

DOS

IR

Vibrations