Geometry & MOs

Info

ID:	26901
PubChem CID:	803908
Reduced:	O5H16C18 (1)
Stoich.:	A5B16C18 (1)
Weight, g/mol:	259.053069
ΔH_f, kcal/mol:	-123.59
Dipole, Da:	6.09
IP(EA), eV:	-8.74(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,4-dichlorophenoxy)ethyl]pyrrolidine

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)OC(=CC2=O)C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations