Geometry & MOs

Info

ID:

324516

PubChem CID:

126677799

Reduced:

PF3N5O5C38H43 (1)

Stoich.:

AB3C5D5E38F43 (1)

Weight, g/mol:

1165.32916

ΔHf, kcal/mol:

-308.06

Dipole, Da:

9.22

IP(EA), eV:

 -9.36(-0.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(3S,5R,6R)-5-acetamido-6-[5-[2-[5-[(2R,3S,5R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentoxymethyl]-3-[5-[(2R,3S)-3-amino-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentoxy]-2-methylpropoxy]pentoxy]-2-(hydroxymethyl)-4-iodooxan-3-yl] hypoiodite

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)C2CN(CC(O2)COP(C)N3CCC(CC3)N(C)C(=O)C(F)(F)F)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations