Geometry & MOs

Info

ID:	183088
PubChem CID:	76977254
Reduced:	ON4C15H22 (1)
Stoich.:	AB4C15D22 (1)
Weight, g/mol:	253.071448
ΔH_f, kcal/mol:	-4.26
Dipole, Da:	6.99
IP(EA), eV:	-8.67(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7,8-trifluoro-2-methyl-3-propan-2-ylidenequinolin-4-one

Drug info:

PubChemData

Smile

C1CC2CNNC2CC1C(=O)NCCC3=CC=NC=C3

DOS

IR

Vibrations