Geometry & MOs

Info

ID:	355080
PubChem CID:	127287941
Reduced:	O3N4C17H22 (1)
Stoich.:	A3B4C17D22 (1)
Weight, g/mol:	294.115047
ΔH_f, kcal/mol:	-115.79
Dipole, Da:	6.14
IP(EA), eV:	-9.03(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-[4-(1,3-thiazol-4-ylmethyl)piperazine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CC(=O)N[C@H]1C(=O)N2CCC(CC2)NC(=O)NC3=CC=CC=C3

DOS

IR

Vibrations