Geometry & MOs

Info

ID:	164033
PubChem CID:	74381575
Reduced:	OF3N6H23C25 (1)
Stoich.:	AB3C6D23E25 (1)
Weight, g/mol:	356.129156
ΔH_f, kcal/mol:	-6.03
Dipole, Da:	4.85
IP(EA), eV:	-8.36(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-(2-piperidin-1-ylethoxy)-8aH-acridin-9-one

Drug info:

PubChemData

Smile

CON=C(C1=CC=C(C=C1)F)C2=CC3=CN=C(N=C3N2C4=C(C=CC=C4F)F)NN5CCCCC5

DOS

IR

Vibrations