Geometry & MOs

Info

ID:

47214

PubChem CID:

10530672

Reduced:

SiO2H32C38 (1)

Stoich.:

AB2C32D38 (1)

Weight, g/mol:

549.215138

ΔHf, kcal/mol:

19.48

Dipole, Da:

3.21

IP(EA), eV:

 -8.92(-0.59)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl (2S,3S)-3-[(R)-(3,4-dimethoxyphenyl)-hydroxymethyl]-4-oxo-1-(9-phenylfluoren-9-yl)pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

C=C[C@H](C1=CC=CC2=CC=CC=C21)O[Si](C3=CC=CC=C3)(C4=CC=CC=C4)O[C@H](C=C)C5=CC=CC6=CC=CC=C65

DOS

IR

Vibrations