Geometry & MOs

Info

ID:	332712
PubChem CID:	127250998
Reduced:	O4N5C21H23 (1)
Stoich.:	A4B5C21D23 (1)
Weight, g/mol:	407.16452
ΔH_f, kcal/mol:	-29.78
Dipole, Da:	3.73
IP(EA), eV:	-9.15(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-1-[2-[6-(3-methoxyphenyl)pyrazin-2-yl]morpholin-4-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)CN2CCOC(C2)C3=NC(=CN=C3)C4=CC(=CC=C4)OC

DOS

IR

Vibrations