Geometry & MOs

Info

ID:	219025
PubChem CID:	85090382
Reduced:	O7C32H44 (1)
Stoich.:	A7B32C44 (1)
Weight, g/mol:	540.266445
ΔH_f, kcal/mol:	-278.57
Dipole, Da:	4.14
IP(EA), eV:	-9.18(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-naphthalen-1-ylpentyl)-3-(trityloxymethyl)oxetan-2-one

Drug info:

PubChemData

Smile

CC1C2C(C(C(C1OCC3=CC=CC=C3)(O2)C)O)C(C(C)C4C(C(C(O4)(C)OC)OCC5=CC=CC=C5)C)O

DOS

IR

Vibrations