Geometry & MOs

Info

ID:	191912
PubChem CID:	78200230
Reduced:	BrH3O3N4C7 (1)
Stoich.:	AB3C3D4E7 (1)
Weight, g/mol:	285.092042
ΔH_f, kcal/mol:	75.77
Dipole, Da:	4.81
IP(EA), eV:	-10.41(-3.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-4-chloro-4H-acridin-9-one

Drug info:

PubChemData

Smile

C1=C(C=C2C(=NN=NC2=O)C1Br)[N+](=O)[O-]

DOS

IR

Vibrations