Geometry & MOs

Info

ID:	31495
PubChem CID:	855788
Reduced:	ClSN4H11C17 (1)
Stoich.:	ABC4D11E17 (1)
Weight, g/mol:	348.158626
ΔH_f, kcal/mol:	154.82
Dipole, Da:	3.26
IP(EA), eV:	-8.39(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-methoxyphenyl)piperazin-1-yl]-quinoxalin-6-ylmethanone

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)C2=NNC(=C3C=C(C=CC3=N2)Cl)C4=CC=CS4

DOS

IR

Vibrations