Geometry & MOs

Info

ID:

225528

PubChem CID:

85852725

Reduced:

O9N10C40H58 (1)

Stoich.:

A9B10C40D58 (1)

Weight, g/mol:

498.17822

ΔHf, kcal/mol:

-394.13

Dipole, Da:

3.41

IP(EA), eV:

 -9.34(-0.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[4-(3,5-difluoro-4-propylphenyl)-3,5-difluorophenyl]-2,3-difluoro-4-(4-propylphenyl)benzene

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC(C(C)C)C(=O)NC(CC1=CN=CN1)C(=O)N2CCCC2C(=O)N3CCCC3C(=O)O)NC(=O)C(CC4=CC=CC=C4)NC(=O)C(CC(=O)N)N

DOS

IR

Vibrations