Geometry & MOs

Info

ID:

375963

PubChem CID:

134221960

Reduced:

NPO12C48H56 (1)

Stoich.:

ABC12D48E56 (1)

Weight, g/mol:

734.345483

ΔHf, kcal/mol:

-432.4

Dipole, Da:

4.89

IP(EA), eV:

 -9.28(0.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2,2-dimethyl-6-[5-(naphthalen-2-ylmethoxy)-2,3,4-tris(phenylmethoxy)pentoxy]-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3]dioxin-7-ol

Drug info:

PubChemData

Smile

CN(C)C(=O)OC1C(C(OC1OCC(C(C(COP(O)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)COCC6=CC=CC=C6)O

DOS

IR

Vibrations