Geometry & MOs

Info

ID:	304199
PubChem CID:	124498628
Reduced:	ClON2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	238.087291
ΔH_f, kcal/mol:	-39.87
Dipole, Da:	6.51
IP(EA), eV:	-9.53(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-2-(6-chloro-4-methylpyridin-3-yl)pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1[C@@H]2CCCN2C(=O)C)Cl

DOS

IR

Vibrations