Geometry & MOs

Info

ID:	265653
PubChem CID:	103537005
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	226.087291
ΔH_f, kcal/mol:	-50.38
Dipole, Da:	3.81
IP(EA), eV:	-9.31(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(chloromethyl)-2-(3-methoxypyrrolidin-1-yl)pyridine

Drug info:

PubChemData

Smile

COC1CCN(C1)C(=O)C2=NC=C(C=C2)C#CCCO

DOS

IR

Vibrations