Geometry & MOs

Info

ID:	169414
PubChem CID:	75101783
Reduced:	O2N4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	287.236148
ΔH_f, kcal/mol:	-39.08
Dipole, Da:	2.7
IP(EA), eV:	-8.73(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3-methylphenyl)pyrazolidin-3-yl]-1-propylpiperidine

Drug info:

PubChemData

Smile

CCN1C=CN=C1C2CC3CN(C(=O)C34N2CCC4)C5=CC(=CC=C5)OC

DOS

IR

Vibrations