Geometry & MOs

Info

ID:	304092
PubChem CID:	124492814
Reduced:	BrN2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	310.204513
ΔH_f, kcal/mol:	10.93
Dipole, Da:	3.89
IP(EA), eV:	-8.69(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenylmethoxy-5-[(2S)-1-propylpiperidin-2-yl]pyridine

Drug info:

PubChemData

Smile

CC(C)N1CCC[C@H]1C2=C(N=CC=C2)Br

DOS

IR

Vibrations