Geometry & MOs

Info

ID:

230745

PubChem CID:

87571860

Reduced:

SnO4C24H46 (1)

Stoich.:

AB4C24D46 (1)

Weight, g/mol:

528.211923

ΔHf, kcal/mol:

-216.79

Dipole, Da:

5.43

IP(EA), eV:

 -7.78(-0.68)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2R,3S,4S,5R,6R)-6-[4-[(4-ethoxy-3-fluorophenyl)methyl]-5-methyl-1-propan-2-ylpyrazol-3-yl]oxy-3,4,5,6-tetrahydroxyoxan-2-yl]methyl methyl carbonate

Drug info:

PubChemData

Smile

CCCCCC(CC)(CC)C(CCCC(=O)[O-])C(=O)[O-].CCCC[Sn+2]CCCC

DOS

IR

Vibrations