Geometry & MOs

Info

ID:	208983
PubChem CID:	80609039
Reduced:	OSN4C12H22 (1)
Stoich.:	ABC4D12E22 (1)
Weight, g/mol:	287.084081
ΔH_f, kcal/mol:	-10.31
Dipole, Da:	4.1
IP(EA), eV:	-8.9(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]methyl]quinoxalin-2-one

Drug info:

PubChemData

Smile

CCNC1=NN=C(S1)CN(C)CC2CCCOC2

DOS

IR

Vibrations