Geometry & MOs

Info

ID:

185385

PubChem CID:

77292646

Reduced:

ClFPN3O9C23H31 (1)

Stoich.:

ABCD3E9F23G31 (1)

Weight, g/mol:

551.146895

ΔHf, kcal/mol:

-451.3

Dipole, Da:

8.81

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.759881

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCOC(=O)C(C)N=P(=O)OC(C1C(C(C(O1)N2CCC(=O)NC2=O)(C)F)O)OC3=CC=CC=C3Cl

DOS

IR

Vibrations