Geometry & MOs

Info

ID:	344303
PubChem CID:	127267479
Reduced:	NOC6H7 (3)
Stoich.:	ABC6D7 (3)
Weight, g/mol:	349.200156
ΔH_f, kcal/mol:	-35.42
Dipole, Da:	3.03
IP(EA), eV:	-8.42(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(5-methoxypyridin-3-yl)piperazin-1-yl]-2-(oxolan-2-ylmethoxy)propan-1-one

Drug info:

PubChemData

Smile

COC1=CN=CC(=C1)N2CCN(CC2)C(=O)C3=C(OC=C3)C4CC4

DOS

IR

Vibrations