Geometry & MOs

Info

ID:

16654

PubChem CID:

474428

Reduced:

F2N2O5C33H34 (1)

Stoich.:

A2B2C5D33E34 (1)

Weight, g/mol:

576.243579

ΔHf, kcal/mol:

-268.83

Dipole, Da:

3.36

IP(EA), eV:

 -8.79(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl (2S)-1-[(2S)-3-(2,6-difluorophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@@H]1CCCN1C(=O)[C@H](CC2=C(C=CC=C2F)F)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

DOS

IR

Vibrations