Geometry & MOs

Info

ID:	393446
PubChem CID:	135020617
Reduced:	BrO5C19H21 (1)
Stoich.:	AB5C19D21 (1)
Weight, g/mol:	378.04667
ΔH_f, kcal/mol:	-130.24
Dipole, Da:	3.54
IP(EA), eV:	-8.67(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-(2-bromo-3,4,5-trimethoxyphenyl)-3-phenylprop-2-en-1-ol

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)/C=C/C(C2=CC(=C(C(=C2Br)OC)OC)OC)O

DOS

IR

Vibrations