Geometry & MOs

Info

ID:	419154
PubChem CID:	135107613
Reduced:	ClON4C13H17 (1)
Stoich.:	ABC4D13E17 (1)
Weight, g/mol:	404.221226
ΔH_f, kcal/mol:	6.12
Dipole, Da:	3.74
IP(EA), eV:	-9.34(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-oxo-3-(2-phenylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)propyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)Cl)NC2=NN=C(O2)C(C)(C)N

DOS

IR

Vibrations