Geometry & MOs

Info

ID:

185123

PubChem CID:

77258468

Reduced:

Cl2N5C20H27 (1)

Stoich.:

A2B5C20D27 (1)

Weight, g/mol:

762.327622

ΔHf, kcal/mol:

13.68

Dipole, Da:

7.94

IP(EA), eV:

 -8.92(-0.51)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-O-[4-[[4-[5-(1-amino-2-oxopropyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy]methyl]piperidin-4-yl] 1-O,5-O-dibenzyl 1-aminopentane-1,1,5-tricarboxylate

Drug info:

PubChemData

Smile

CC1CCN(CC1N(C)C2=C3C(=NC=C2)N=CN3)CC4=CC=CC=C4.Cl.Cl

DOS

IR

Vibrations