Geometry & MOs

Info

ID:

441009

PubChem CID:

135232682

Reduced:

IN4H7C8 (1)

Stoich.:

AB4C7D8 (1)

Weight, g/mol:

1179.465336

ΔHf, kcal/mol:

100.74

Dipole, Da:

1.53

IP(EA), eV:

-8.7(-1.23)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[5-[3-acetamido-5-[3-acetamido-5-[3-acetamido-5-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-3-yl]acetamide

Drug info:

PubChemData

Smile

C1=CC(=NC=C1I)N2C=CC(=N2)N

DOS

IR

Vibrations