Geometry & MOs

Info

ID:	55010
PubChem CID:	17389655
Reduced:	ClNC13H20 (1)
Stoich.:	ABC13D20 (1)
Weight, g/mol:	281.126323
ΔH_f, kcal/mol:	-31.54
Dipole, Da:	1.24
IP(EA), eV:	-9.04(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methoxyphenyl)methyl]pyrrolidine;oxalic acid

Drug info:

PubChemData

Smile

CCC(C1CCCN1)C2=CC=CC=C2.Cl

DOS

IR

Vibrations