Geometry & MOs

Info

ID:	55222
PubChem CID:	17389917
Reduced:	N2F3C12H15 (1)
Stoich.:	A2B3C12D15 (1)
Weight, g/mol:	244.053404
ΔH_f, kcal/mol:	-148.11
Dipole, Da:	6.62
IP(EA), eV:	-8.58(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dichloro-N-(pyrrolidin-2-ylmethyl)aniline

Drug info:

PubChemData

Smile

C1CC(NC1)CNC2=CC=CC(=C2)C(F)(F)F

DOS

IR

Vibrations