Geometry & MOs

Info

ID:	412103
PubChem CID:	135084976
Reduced:	ClF2O2H3C8 (1)
Stoich.:	AB2C2D3E8 (1)
Weight, g/mol:	858.435636
ΔH_f, kcal/mol:	-124.14
Dipole, Da:	2.02
IP(EA), eV:	-10.14(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,8-bis[(R)-[(2S,4S,5S)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methoxy]-4a,9a-dihydroanthracene-9,10-dione

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1F)F)Cl)C(=O)C=O

DOS

IR

Vibrations