Geometry & MOs

Info

ID:	345218
PubChem CID:	127268978
Reduced:	ON3C7H9 (2)
Stoich.:	AB3C7D9 (2)
Weight, g/mol:	385.186238
ΔH_f, kcal/mol:	12.73
Dipole, Da:	5.37
IP(EA), eV:	-9.46(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)NC3=CC=NC=C3

DOS

IR

Vibrations