Geometry & MOs

Info

ID:	55087
PubChem CID:	17389748
Reduced:	ClNC6H9 (2)
Stoich.:	ABC6D9 (2)
Weight, g/mol:	204.162649
ΔH_f, kcal/mol:	-37.41
Dipole, Da:	4.74
IP(EA), eV:	-8.47(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-(pyrrolidin-2-ylmethyl)aniline

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NCC2CCCN2)Cl.Cl

DOS

IR

Vibrations