Geometry & MOs

Info

ID:	257533
PubChem CID:	103146853
Reduced:	NO2F4H9C10 (1)
Stoich.:	AB2C4D9E10 (1)
Weight, g/mol:	290.112979
ΔH_f, kcal/mol:	-250.53
Dipole, Da:	0.37
IP(EA), eV:	-10.68(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxyphenyl)-5-(2,2,2-trifluoroethoxy)pentan-3-one

Drug info:

PubChemData

Smile

C1=C(C=NC=C1F)C(=O)CCOCC(F)(F)F

DOS

IR

Vibrations