Geometry & MOs

Info

ID:

324250

PubChem CID:

126677233

Reduced:

ON3C10H17 (1)

Stoich.:

AB3C10D17 (1)

Weight, g/mol:

568.295573

ΔHf, kcal/mol:

-19.38

Dipole, Da:

2.03

IP(EA), eV:

-8.28(0.77)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2S)-4-amino-N-[(1R,4R)-5-amino-4-[(2S,5S)-3-amino-4,5-dihydroxy-6-[(1R)-1-hydroxyethyl]oxan-2-yl]oxy-3-[(2S,5R)-5-ethyl-3,4-dihydroxyoxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide

Drug info:

PubChemData

Smile

C[C@H]1CC[C@@H](CN1C2=NN(C=C2)C)O

DOS

IR

Vibrations