Geometry & MOs

Info

ID:	149337
PubChem CID:	53789009
Reduced:	O3H9C10F11 (1)
Stoich.:	A3B9C10D11 (1)
Weight, g/mol:	441.216475
ΔH_f, kcal/mol:	-696.66
Dipole, Da:	3.09
IP(EA), eV:	-10.43(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-cyanophenoxy)phenyl]-N-(2-ethylpyrimidin-4-yl)-3-(2-methylpropylimino)propanamide

Drug info:

PubChemData

Smile

C=CCCOCC(OC(C(OC(C(F)(F)F)(F)F)(F)F)(F)F)(F)F

DOS

IR

Vibrations