Geometry & MOs

Info

ID:	304247
PubChem CID:	124499736
Reduced:	N3C18H23 (1)
Stoich.:	A3B18C23 (1)
Weight, g/mol:	325.179027
ΔH_f, kcal/mol:	41.85
Dipole, Da:	2.79
IP(EA), eV:	-8.4(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)NC)[C@@H]2CCCN2CC3=CC=CC=C3

DOS

IR

Vibrations