Geometry & MOs

Info

ID:	128337
PubChem CID:	51040424
Reduced:	O2F3H15C17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	346.141638
ΔH_f, kcal/mol:	-166.34
Dipole, Da:	5.03
IP(EA), eV:	-9.32(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,2S,3S)-3,5-bis(4-hydroxy-3-methoxyphenyl)pent-4-ene-1,2-diol

Drug info:

PubChemData

Smile

C/C(=C\C=C\C(=C\C(=O)O)\C)/C=C/C1=CC(=C(C=C1F)F)F

DOS

IR

Vibrations