Geometry & MOs

Info

ID:	365640
PubChem CID:	127318361
Reduced:	ON2C10H13 (2)
Stoich.:	AB2C10D13 (2)
Weight, g/mol:	343.16444
ΔH_f, kcal/mol:	-18.31
Dipole, Da:	3.58
IP(EA), eV:	-9.3(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-morpholin-4-ylethyl)-4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C2=NOC(=N2)C3CCCN(C3)C(=O)N4CCCC4

DOS

IR

Vibrations