Geometry & MOs

Info

ID:	313307
PubChem CID:	126613674
Reduced:	O2C11H12 (2)
Stoich.:	A2B11C12 (2)
Weight, g/mol:	458.135446
ΔH_f, kcal/mol:	-151.12
Dipole, Da:	2.94
IP(EA), eV:	-8.92(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,4-trifluoro-1-(furan-2-yl)-1-N,3-N-di(quinolin-3-yl)butane-1,3-diimine

Drug info:

PubChemData

Smile

CCCC(=O)OC1(C2=CC=CC=C2C3=CC=CC(=C31)C)OC(=O)CCC

DOS

IR

Vibrations