Geometry & MOs

Info

ID:	345645
PubChem CID:	127269945
Reduced:	O3N6C16H20 (1)
Stoich.:	A3B6C16D20 (1)
Weight, g/mol:	358.138953
ΔH_f, kcal/mol:	-7.98
Dipole, Da:	3.76
IP(EA), eV:	-8.9(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-oxoethyl]-3-pyrazin-2-yl-1,2,4-oxadiazol-5-one

Drug info:

PubChemData

Smile

C1CC1N2CCC(CC2)NC(=O)CN3C(=NOC3=O)C4=NC=CN=C4

DOS

IR

Vibrations