Geometry & MOs

Info

ID:	332781
PubChem CID:	127251091
Reduced:	ClO2N4H21C22 (1)
Stoich.:	AB2C4D21E22 (1)
Weight, g/mol:	317.093104
ΔH_f, kcal/mol:	5.65
Dipole, Da:	5.6
IP(EA), eV:	-9.05(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[3-(3-chlorophenyl)pyrazin-2-yl]morpholin-4-yl]ethanone

Drug info:

PubChemData

Smile

C1COC(CN1CC2=CC=CC=C2Cl)C3=NC=CN=C3C4=CC=C(C=C4)C(=O)N

DOS

IR

Vibrations