Geometry & MOs

Info

ID:

229111

PubChem CID:

87566975

Reduced:

NO4C20H35 (1)

Stoich.:

AB4C20D35 (1)

Weight, g/mol:

1536.857393

ΔHf, kcal/mol:

-233.78

Dipole, Da:

4.95

IP(EA), eV:

-9.76(0.47)

Spin(Sz, S2):

None, None

Charge, e:

-1

Chem-info

IUPAC name:

N-[4-[1-(4-amino-5-hydroxypentanoyl)piperidin-3-yl]-4-[2-(3-ethylphenyl)-3-fluorophenyl]-4-hydroxybutyl]-N-[5,6-dicarbamoyl-10-[3-fluoro-2-(2-fluoro-5-methylphenyl)phenyl]-1-[3-fluoro-2-(3-methylphenyl)phenyl]-1,10-dihydroxy-1,10-bis[1-[4-(methylamino)butanoyl]piperidin-3-yl]decan-5-yl]carbamate

Drug info:

PubChemData

Smile

CCCCCCCCCC(=O)CC(=O)N1CCCCC1C(=O)OCC

DOS

IR

Vibrations