Geometry & MOs

Info

ID:	332790
PubChem CID:	127251214
Reduced:	FO3N5C20H20 (1)
Stoich.:	AB3C5D20E20 (1)
Weight, g/mol:	409.175004
ΔH_f, kcal/mol:	-46.28
Dipole, Da:	4.92
IP(EA), eV:	-9.68(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCC(=O)N2CCOC(C2)C3=NC=CN=C3C4=CC(=CC=C4)F

DOS

IR

Vibrations