Geometry & MOs

Info

ID:	394571
PubChem CID:	135023245
Reduced:	NF3H12C18 (1)
Stoich.:	AB3C12D18 (1)
Weight, g/mol:	260.141245
ΔH_f, kcal/mol:	-81.3
Dipole, Da:	5.22
IP(EA), eV:	-9.55(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-phenylmethoxyethyl)-2-prop-2-enyloxolan-3-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C=CC(=C2)C(F)(F)F)C3=CC=CC=N3

DOS

IR

Vibrations