Geometry & MOs

Info

ID:	32503
PubChem CID:	7840033
Reduced:	NO3C24H29 (1)
Stoich.:	AB3C24D29 (1)
Weight, g/mol:	419.189672
ΔH_f, kcal/mol:	-118.86
Dipole, Da:	2.43
IP(EA), eV:	-9.39(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-fluorophenyl)-2-oxoethyl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[C@H]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)O[C@H]4CCCCC4=O

DOS

IR

Vibrations