Geometry & MOs

Info

ID:	148114
PubChem CID:	53787776
Reduced:	ClFNS2H15C22 (1)
Stoich.:	ABCD2E15F22 (1)
Weight, g/mol:	345.07283
ΔH_f, kcal/mol:	49.65
Dipole, Da:	4.46
IP(EA), eV:	-8.47(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-4-(4-bromophenoxy)-1-methyl-3-phenylpiperidine

Drug info:

PubChemData

Smile

CSC1=CC=C(C=C1)C2=C(N=C(S2)C3=CC=CC=C3Cl)C4=CC=C(C=C4)F

DOS

IR

Vibrations