Geometry & MOs

Info

ID:	418738
PubChem CID:	135106671
Reduced:	O2N3C17H21 (1)
Stoich.:	A2B3C17D21 (1)
Weight, g/mol:	357.151098
ΔH_f, kcal/mol:	-45.51
Dipole, Da:	4.73
IP(EA), eV:	-9.1(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-1-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrrolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CN(C1C[C@@H]2CC(C[C@@H]2C1)O)C(=O)C3=NNC4=CC=CC=C43

DOS

IR

Vibrations