Geometry & MOs

Info

ID:	217583
PubChem CID:	85088050
Reduced:	O5H22C23 (1)
Stoich.:	A5B22C23 (1)
Weight, g/mol:	378.06193
ΔH_f, kcal/mol:	-139.5
Dipole, Da:	9.25
IP(EA), eV:	-9.31(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-bromo-1-(4-ethylphenyl)-2-phenylethenyl]phenol

Drug info:

PubChemData

Smile

CC(=CCC1=C(C=CC(=C1)C=CC(=O)O)OC(=O)C=CC2=CC=C(C=C2)O)C

DOS

IR

Vibrations