Geometry & MOs

Info

ID:

436496

PubChem CID:

135204465

Reduced:

ON7C27H31 (1)

Stoich.:

AB7C27D31 (1)

Weight, g/mol:

563.204334

ΔHf, kcal/mol:

59.23

Dipole, Da:

3.01

IP(EA), eV:

 -8.57(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(5R)-3-[2-[(4-fluorophenyl)methyl-(1,1,1-trifluoropropan-2-yl)amino]-2-oxoethyl]-2',4'-dioxospiro[1,3-oxazolidine-5,1'-3,3a-dihydroindene]-5'-yl]cyclobutanecarboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC2=NC=C(C=C2)C3=C4C(=NC=C3)NN=C4NC5CCNC5

DOS

IR

Vibrations