Geometry & MOs

Info

ID:	332751
PubChem CID:	127251061
Reduced:	FO3N5C22H24 (1)
Stoich.:	AB3C5D22E24 (1)
Weight, g/mol:	437.206304
ΔH_f, kcal/mol:	-73.99
Dipole, Da:	3.5
IP(EA), eV:	-9.63(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[6-(4-methoxyphenyl)pyrazin-2-yl]morpholin-4-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C)C1=NN=C(O1)CCC(=O)N2CCOC(C2)C3=NC(=CN=C3)C4=CC=CC=C4F

DOS

IR

Vibrations