Geometry & MOs

Info

ID:

57537

PubChem CID:

22405482

Reduced:

F3N4O4C21H23 (1)

Stoich.:

A3B4C4D21E23 (1)

Weight, g/mol:

550.167534

ΔHf, kcal/mol:

-281.99

Dipole, Da:

5.67

IP(EA), eV:

 -9.0(-1.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2,5-dioxopyrrolidin-1-yl)methyl N-[2-oxo-1-[2-oxo-2-[(1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl)amino]ethyl]-6-phenylpyridin-3-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)C(C(=O)C(F)(F)F)NC(=O)CN1C(=CC=C(C1=O)NC(=O)CN)C2=CC=CC=C2

DOS

IR

Vibrations