Geometry & MOs

Info

ID:	219059
PubChem CID:	85090421
Reduced:	O5C14H24 (2)
Stoich.:	A5B14C24 (2)
Weight, g/mol:	544.26136
ΔH_f, kcal/mol:	-521.74
Dipole, Da:	1.88
IP(EA), eV:	-10.48(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-7-naphthalen-1-yl-2-(trityloxymethyl)heptanoic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCOC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations