Geometry & MOs

Info

ID:	238774
PubChem CID:	93165476
Reduced:	ON2C19H32 (1)
Stoich.:	AB2C19D32 (1)
Weight, g/mol:	305.173942
ΔH_f, kcal/mol:	-55.68
Dipole, Da:	1.91
IP(EA), eV:	-8.59(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(2S)-2-[methyl(2-pyridin-4-ylethyl)amino]propanoyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCOC1=CC=CC(=C1)[C@H](CN)N2CCC[C@@H](C2)C

DOS

IR

Vibrations