Geometry & MOs

Info

ID:	432273
PubChem CID:	135172405
Reduced:	N3C15H23 (1)
Stoich.:	A3B15C23 (1)
Weight, g/mol:	284.141245
ΔH_f, kcal/mol:	39.07
Dipole, Da:	3.26
IP(EA), eV:	-8.0(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-phenylphenoxy)ethoxy]butan-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2CCN(CC2)C3CN(C3)C

DOS

IR

Vibrations