Geometry & MOs

Info

ID:	419908
PubChem CID:	135109694
Reduced:	ClN3O4C17H20 (1)
Stoich.:	AB3C4D17E20 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	-136.37
Dipole, Da:	5.17
IP(EA), eV:	-9.08(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-4-yl]oxymethyl]pyridine

Drug info:

PubChemData

Smile

CC1=NC=C(N1)CN(CCO)C(=O)CC2=CC3=C(C=C2Cl)OCCO3

DOS

IR

Vibrations