Geometry & MOs

Info

ID:

329067

PubChem CID:

126730975

Reduced:

PN2O7C21H35 (1)

Stoich.:

AB2C7D21E35 (1)

Weight, g/mol:

1018.592375

ΔHf, kcal/mol:

-402.26

Dipole, Da:

3.95

IP(EA), eV:

 -8.83(-0.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3R,5R)-2-[(3R,5R)-6-[24-[(2R,4R,5S)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxytetracosoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Drug info:

PubChemData

Smile

CCOP(=O)(C)OC1=C(C=C(C=C1)NC(=O)CCCCCNC(=O)OC(C)(C)C)CO

DOS

IR

Vibrations