Geometry & MOs

Info

ID:	366860
PubChem CID:	127320640
Reduced:	O3N4C13H20 (1)
Stoich.:	A3B4C13D20 (1)
Weight, g/mol:	280.153541
ΔH_f, kcal/mol:	-46.98
Dipole, Da:	3.31
IP(EA), eV:	-9.02(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-cyclopropylpiperazin-1-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]ethanone

Drug info:

PubChemData

Smile

CC1=NOC(=N1)COCC(=O)NC2CCN(C2)C3CC3

DOS

IR

Vibrations