Geometry & MOs

Info

ID:	138175
PubChem CID:	52323590
Reduced:	N2O5C19H20 (1)
Stoich.:	A2B5C19D20 (1)
Weight, g/mol:	471.156099
ΔH_f, kcal/mol:	-153.39
Dipole, Da:	6.41
IP(EA), eV:	-8.76(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-(4-benzoylpiperazine-1-carbonyl)-1-(5-chloro-2,4-dimethoxyphenyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

C[C@H](C(=O)OCC(=O)N1CCCC2=CC=CC=C21)NC(=O)C3=CC=CO3

DOS

IR

Vibrations