Geometry & MOs

Info

ID:

413051

PubChem CID:

135085995

Reduced:

FNO3C12H14 (1)

Stoich.:

ABC3D12E14 (1)

Weight, g/mol:

610.33258

ΔHf, kcal/mol:

-120.04

Dipole, Da:

1.57

IP(EA), eV:

 -9.84(-0.86)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S,4S,5S,7R,10S,11R,12S,16S,19R)-4,19,21,21-tetramethyl-2-methylidene-10-phenylmethoxy-5-triethylsilyloxy-8,13,15,20-tetraoxahexacyclo[14.4.1.01,19.04,11.07,10.012,16]henicosan-14-one

Drug info:

PubChemData

Smile

CN(C(=O)CCC(=O)C1=CC=C(C=C1)F)OC

DOS

IR

Vibrations