Geometry & MOs

Info

ID:

81485

PubChem CID:

49854778

Reduced:

SN2O16C38H72 (1)

Stoich.:

AB2C16D38E72 (1)

Weight, g/mol:

868.467366

ΔHf, kcal/mol:

-772.77

Dipole, Da:

7.88

IP(EA), eV:

-8.99(-0.89)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

sodium;dihydrogen phosphate;(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3,4,10-trihydroxy-13-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,6,8,10,12,14-heptamethyl-1-oxa-6-azacyclopentadecan-15-one

Drug info:

PubChemData

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DOS

IR

Vibrations