Geometry & MOs

Info

ID:	305656
PubChem CID:	124963971
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	317.190341
ΔH_f, kcal/mol:	-55.64
Dipole, Da:	2.41
IP(EA), eV:	-8.87(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(1,4-dimethylimidazol-2-yl)-1-[(2-fluoro-4-methoxyphenyl)methyl]piperidine

Drug info:

PubChemData

Smile

C1CO[C@@H](CN1CC2=CC(=CC=C2)OCCO)C3=NC=CN=C3

DOS

IR

Vibrations