Geometry & MOs

Info

ID:	304232
PubChem CID:	124499687
Reduced:	O2N3C19H23 (1)
Stoich.:	A2B3C19D23 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-49.7
Dipole, Da:	2.03
IP(EA), eV:	-8.55(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-[4-methyl-6-(methylamino)pyridin-3-yl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1[C@H]2CCCN2C(=O)OCC3=CC=CC=C3)NC

DOS

IR

Vibrations