Geometry & MOs

Info

ID:

128629

PubChem CID:

51052428

Reduced:

NO5H29C36 (1)

Stoich.:

AB5C29D36 (1)

Weight, g/mol:

567.080427

ΔHf, kcal/mol:

-55.59

Dipole, Da:

5.24

IP(EA), eV:

 -7.95(-1.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1R,2S)-2-(2,4-dichlorophenyl)-1-(4-fluorobenzoyl)spiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1',3'-dione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N3[C@H]([C@@H](C4(C3C=C2)C(=O)C5=CC=CC=C5C4=O)C6=C(C=C(C=C6)OC)OC)C(=O)C7=CC=CC=C7

DOS

IR

Vibrations