Geometry & MOs

Info

ID:	421594
PubChem CID:	135116278
Reduced:	N2O4C17H24 (1)
Stoich.:	A2B4C17D24 (1)
Weight, g/mol:	365.221561
ΔH_f, kcal/mol:	-68.14
Dipole, Da:	3.49
IP(EA), eV:	-8.83(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1H-imidazol-2-yl)-1-[[3-(3-imidazol-1-ylpropoxy)phenyl]methyl]piperidine

Drug info:

PubChemData

Smile

CN1C[C@H]2CN([C@@H](C1)COC2)C(=O)C3=C(C(=CC=C3)OC)OC

DOS

IR

Vibrations