Geometry & MOs

Info

ID:	214455
PubChem CID:	85083067
Reduced:	N2O3F6C26H34 (1)
Stoich.:	A2B3C6D26E34 (1)
Weight, g/mol:	536.183503
ΔH_f, kcal/mol:	-470.93
Dipole, Da:	2.47
IP(EA), eV:	-8.77(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-hydroxy-6-[2-hydroxy-3-[3-hydroxy-2-(3-phenylprop-2-enoyl)phenoxy]propoxy]phenyl]-3-phenylprop-2-en-1-one

Drug info:

PubChemData

Smile

CC(C)(C1(CCC(C1)N2CCCC3C2CCOC3)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)O

DOS

IR

Vibrations