Geometry & MOs

Info

ID:

215238

PubChem CID:

85084411

Reduced:

N3O10C42H65 (1)

Stoich.:

A3B10C42D65 (1)

Weight, g/mol:

771.332899

ΔHf, kcal/mol:

-401.1

Dipole, Da:

3.4

IP(EA), eV:

 -8.63(-0.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl-[[10-[tert-butyl(diphenyl)silyl]oxy-3-oxo-3-phenyl-7-oxa-8-aza-3lambda5-phosphatricyclo[6.3.0.02,6]undecan-11-yl]oxy]-diphenylsilane

Drug info:

PubChemData

Smile

CCC1C(C=C(C=CC(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(C(C(O2)C)OCCCC3=CC=CC=N3)N(C)C)O)CC=O)C)C)N4CCOCC4

DOS

IR

Vibrations