Geometry & MOs

Info

ID:	17393
PubChem CID:	495595
Reduced:	O5H36C37 (1)
Stoich.:	A5B36C37 (1)
Weight, g/mol:	560.256274
ΔH_f, kcal/mol:	-107.27
Dipole, Da:	2.0
IP(EA), eV:	-8.2(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-methyl-4,5-bis(phenylmethoxy)oxan-2-yl]-5-phenylmethoxynaphthalen-1-ol

Drug info:

PubChemData

Smile

CC1C(C(CC(O1)C2=C(C3=C(C=C2)C(=CC=C3)OCC4=CC=CC=C4)O)OCC5=CC=CC=C5)OCC6=CC=CC=C6

DOS

IR

Vibrations