Geometry & MOs

Info

ID:	332718
PubChem CID:	127251028
Reduced:	FO2N5H22C24 (1)
Stoich.:	AB2C5D22E24 (1)
Weight, g/mol:	407.16452
ΔH_f, kcal/mol:	-18.29
Dipole, Da:	1.4
IP(EA), eV:	-9.06(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[6-(3-fluorophenyl)pyrazin-2-yl]morpholin-4-yl]-[4-(methoxymethyl)phenyl]methanone

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)CCC2=NC3=CC=CC=C3N2)C4=NC(=CN=C4)C5=CC(=CC=C5)F

DOS

IR

Vibrations