Geometry & MOs

Info

ID:	184388
PubChem CID:	77154767
Reduced:	O5C24H26 (1)
Stoich.:	A5B24C26 (1)
Weight, g/mol:	394.178024
ΔH_f, kcal/mol:	-164.44
Dipole, Da:	4.15
IP(EA), eV:	-8.63(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-2-(6-methoxynaphthalen-2-yl)-6-phenylmethoxyhexanoic acid

Drug info:

PubChemData

Smile

CC(CCC(C1=CC2=C(C=C1)C=C(C=C2)OC)(C(=O)O)O)OCC3=CC=CC=C3

DOS

IR

Vibrations