Geometry & MOs

Info

ID:	266603
PubChem CID:	103574900
Reduced:	O3C11H18 (1)
Stoich.:	A3B11C18 (1)
Weight, g/mol:	224.13472
ΔH_f, kcal/mol:	-162.08
Dipole, Da:	6.38
IP(EA), eV:	-10.54(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-1-[1-(5-methylthiophen-2-yl)ethyl]pyrrolidin-3-amine

Drug info:

PubChemData

Smile

CCCCC1(CCCCC1=O)C(=O)O

DOS

IR

Vibrations