Geometry & MOs

Info

ID:

437297

PubChem CID:

135222153

Reduced:

SF5N5O6H16C18 (2)

Stoich.:

AB5C5D6E16F18 (2)

Weight, g/mol:

854.569669

ΔHf, kcal/mol:

-748.92

Dipole, Da:

6.82

IP(EA), eV:

 -8.96(-1.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

diethyl 2,5-bis[1-[4-(4-propylcyclohexyl)phenoxy]hexoxy]benzene-1,4-dicarboxylate

Drug info:

PubChemData

Smile

CC(=O)N(C1=NN2C(=N1)C(=CN=C2OC)OC)S(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F.CC(=O)N(C1=NN2C(=N1)C(=CN=C2OC)OC)S(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F

DOS

IR

Vibrations