Geometry & MOs

Info

ID:	304200
PubChem CID:	124498629
Reduced:	ClON2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	330.113506
ΔH_f, kcal/mol:	-40.1
Dipole, Da:	6.45
IP(EA), eV:	-9.5(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (2S)-2-(6-chloro-4-methylpyridin-3-yl)pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations