Geometry & MOs

Info

ID:	12279
PubChem CID:	134112
Reduced:	FON2C22H27 (1)
Stoich.:	ABC2D22E27 (1)
Weight, g/mol:	354.210742
ΔH_f, kcal/mol:	-49.08
Dipole, Da:	1.93
IP(EA), eV:	-8.36(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2,3-dihydro-1H-inden-5-yloxy)propyl]-4-(4-fluorophenyl)piperazine

Drug info:

PubChemData

Smile

C1CC2=C(C1)C=C(C=C2)OCCCN3CCN(CC3)C4=CC=C(C=C4)F

DOS

IR

Vibrations