Geometry & MOs

Info

ID:	427694
PubChem CID:	135161380
Reduced:	ClFN4H18C19 (1)
Stoich.:	ABC4D18E19 (1)
Weight, g/mol:	216.162649
ΔH_f, kcal/mol:	39.49
Dipole, Da:	1.16
IP(EA), eV:	-8.3(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethyl)-6-(pyrrolidin-3-ylmethyl)pyridine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN(C(=C2/C(=C(/C3=CC=CC=C3)\N)/Cl)N)CCF

DOS

IR

Vibrations