Geometry & MOs

Info

ID:

300538

PubChem CID:

121360453

Reduced:

PF2N3O10C51H60 (1)

Stoich.:

AB2C3D10E51F60 (1)

Weight, g/mol:

291.12356

ΔHf, kcal/mol:

-543.67

Dipole, Da:

2.49

IP(EA), eV:

 -8.52(-0.78)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4-[2-hydroxy-2-[(methylidene-lambda5-phosphanylidyne)methylamino]ethoxy]cyclohexyl]oxyethane-1,1-diol

Drug info:

PubChemData

Smile

CC(C)(C)C(C(=O)N1CCCC1C(=O)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4)NC(=O)/C=C/C5=CC=C(C=C5)C(F)(F)P(=O)(OCOC(=O)C(C)(C)C)OCOC(=O)C(C)(C)C

DOS

IR

Vibrations