Geometry & MOs

Info

ID:	219350
PubChem CID:	85146937
Reduced:	BF2O3N4C17H21 (1)
Stoich.:	AB2C3D4E17F21 (1)
Weight, g/mol:	377.02627
ΔH_f, kcal/mol:	-301.67
Dipole, Da:	8.88
IP(EA), eV:	-8.46(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-acetyloxy-4-bromo-1,2,3,4-tetrahydroacridin-2-yl) acetate

Drug info:

PubChemData

Smile

B(N1C(=CC(=C1C=C2C=CC(=N2)CCC(=O)NCC(C(=O)O)N)C)C)(F)F

DOS

IR

Vibrations