Geometry & MOs

Info

ID:	866
PubChem CID:	3455
Reduced:	OF2N2C28H32 (1)
Stoich.:	AB2C2D28E32 (1)
Weight, g/mol:	450.24827
ΔH_f, kcal/mol:	-69.17
Dipole, Da:	2.97
IP(EA), eV:	-8.73(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylpropyl)piperazine

Drug info:

PubChemData

Smile

C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

DOS

IR

Vibrations