Geometry & MOs

Info

ID:	326549
PubChem CID:	126687758
Reduced:	NF3C16H20 (1)
Stoich.:	AB3C16D20 (1)
Weight, g/mol:	313.165349
ΔH_f, kcal/mol:	-161.79
Dipole, Da:	5.34
IP(EA), eV:	-8.69(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-1-[[5-(trifluoromethyl)-2,3-dihydro-1H-inden-4-yl]methyl]piperidine

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2=C(C=CC3=C2CCC3)C(F)(F)F

DOS

IR

Vibrations