Geometry & MOs

Info

ID:	314305
PubChem CID:	126621250
Reduced:	NF3C13H14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	408.23006
ΔH_f, kcal/mol:	-132.7
Dipole, Da:	4.8
IP(EA), eV:	-10.29(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[3-(cyclohexanecarbonyl)phenyl]ethoxy]-2-ethoxy-1-phenylpropan-1-one

Drug info:

PubChemData

Smile

CCC(CC)C1=C(C=C(C=C1)C#N)C(F)(F)F

DOS

IR

Vibrations