Geometry & MOs

Info

ID:

302701

PubChem CID:

124392027

Reduced:

ClSN2O4C18H21 (1)

Stoich.:

ABC2D4E18F21 (1)

Weight, g/mol:

498.16383

ΔHf, kcal/mol:

-138.2

Dipole, Da:

6.63

IP(EA), eV:

 -9.01(-0.68)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 5-[[(4Z)-4-[[3-methoxy-4-[(2R)-1-methoxy-1-oxopropan-2-yl]oxy-5-prop-2-enylphenyl]methylidene]-2,5-dioxoimidazolidin-1-yl]methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)S(=O)(=O)N[C@H](C)C(=O)NC2=C(C(=CC=C2)Cl)C

DOS

IR

Vibrations