Geometry & MOs

Info

ID:	130524
PubChem CID:	51091084
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	345.168856
ΔH_f, kcal/mol:	-35.17
Dipole, Da:	5.01
IP(EA), eV:	-9.82(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,3-dimethylmorpholin-4-yl)-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one

Drug info:

PubChemData

Smile

CC1=NOC2=C1C(=CC(=N2)C3CC3)C(=O)N4CCOCC4(C)C

DOS

IR

Vibrations