Geometry & MOs

Info

ID:	225354
PubChem CID:	85756506
Reduced:	NO3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	214.085461
ΔH_f, kcal/mol:	-120.2
Dipole, Da:	4.96
IP(EA), eV:	-9.72(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4H-triazolo[1,5-a]quinoxalin-5-yl)ethanone

Drug info:

PubChemData

Smile

CC(=O)N1CCCCC2=C1C=C(C=C2)C(=O)O

DOS

IR

Vibrations