Geometry & MOs

Info

ID:

147324

PubChem CID:

53786980

Reduced:

O5N6C21H34 (1)

Stoich.:

A5B6C21D34 (1)

Weight, g/mol:

1107.44329

ΔHf, kcal/mol:

-202.72

Dipole, Da:

11.34

IP(EA), eV:

 -9.21(-0.19)

Spin(Sz, S2):

 None, None

Charge, e:

 -3

Chem-info

IUPAC name:

N-[2-[[2-[2-[bis(2-oxopropyl)amino]ethylamino]-2-oxoethyl]-(2-oxopropyl)amino]ethyl]-2-[2-(methylamino)ethyl-(2-oxopropyl)amino]acetamide;[2-[[[2-[[[2-(methoxymethyl)-5-methyloxolan-3-yl]oxy-oxidophosphoryl]oxymethyl]-5-methyloxolan-3-yl]oxy-oxidophosphoryl]oxymethyl]-5-methyloxolan-3-yl]oxy-methylphosphinate

Drug info:

PubChemData

Smile

CCCCCC(=O)OCC[C@H](CN1C=NC2=C1NC(=NC2=O)N)COC(=O)[C@H](C(C)C)N

DOS

IR

Vibrations