Geometry & MOs

Info

ID:

390167

PubChem CID:

134997526

Reduced:

NO2H17C20 (1)

Stoich.:

AB2C17D20 (1)

Weight, g/mol:

1991.643861

ΔHf, kcal/mol:

35.0

Dipole, Da:

4.62

IP(EA), eV:

 -9.64(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3,4,5-tribenzoyloxy-6-[[3,4,5-tribenzoyloxy-6-[[3,4,5-tribenzoyloxy-6-[[6-methoxy-3,4,5-tris(phenylmethoxy)oxan-2-yl]methoxy]oxan-2-yl]methoxy]oxan-2-yl]methoxy]oxan-2-yl]methyl benzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)C#CCNC(=O)/C=C/C2=CC=CC=C2

DOS

IR

Vibrations