Geometry & MOs

Info

ID:	83030
PubChem CID:	49857035
Reduced:	N2O2C21H32 (1)
Stoich.:	A2B2C21D32 (1)
Weight, g/mol:	344.246378
ΔH_f, kcal/mol:	-79.75
Dipole, Da:	2.67
IP(EA), eV:	-8.85(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-piperidin-1-yl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]propan-1-one

Drug info:

PubChemData

Smile

C[C@H]1CCCN1CCCOC2=CC=C(C=C2)C(=O)CN3CCCCC3

DOS

IR

Vibrations