Geometry & MOs

Info

ID:

393103

PubChem CID:

135019381

Reduced:

NO2H21C43 (1)

Stoich.:

AB2C21D43 (1)

Weight, g/mol:

381.163496

ΔHf, kcal/mol:

279.89

Dipole, Da:

8.37

IP(EA), eV:

 -8.64(-1.8)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(2-oxopropoxy)-N-[2-[2-[(2R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethoxy]ethyl]acetamide

Drug info:

PubChemData

Smile

C1C2=CC3=C4C5=C2C6=C1C=C7CC8=C9C1=C2C%10=C%11C%12=C2C2=C9C7=C6C2=C5C%12=C4C2=C%11C(CC%10=CC1=C8)(C=C2C3)NCCCC(=O)O

DOS

IR

Vibrations