Geometry & MOs

Info

ID:	55078
PubChem CID:	17389737
Reduced:	ON2C12H18 (1)
Stoich.:	AB2C12D18 (1)
Weight, g/mol:	434.03248
ΔH_f, kcal/mol:	-20.14
Dipole, Da:	1.76
IP(EA), eV:	-7.88(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(pyrrolidin-2-ylmethyl)aniline;oxalic acid

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NCC2CCCN2

DOS

IR

Vibrations