Geometry & MOs

Info

ID:

214700

PubChem CID:

85083432

Reduced:

NSSiO6C30H49 (1)

Stoich.:

ABCD6E30F49 (1)

Weight, g/mol:

580.322498

ΔHf, kcal/mol:

-331.3

Dipole, Da:

5.58

IP(EA), eV:

 -8.48(-1.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-N-[3-amino-1-(3,5-difluorophenyl)-4-[(6-ethylpyridin-2-yl)methoxy]butan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide

Drug info:

PubChemData

Smile

CCN(CC)CC.CC12CCC3=C4C=CC(=CC4=C(C=C3C1CCC2O)O[Si](C)(C)C(C)(C)C)OS(=O)(=O)O

DOS

IR

Vibrations