Geometry & MOs

Info

ID:	388540
PubChem CID:	134989433
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	248.054555
ΔH_f, kcal/mol:	-94.92
Dipole, Da:	2.44
IP(EA), eV:	-9.56(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-2-(4-nitrophenyl)-1,2,4-triazine-3,5-dione

Drug info:

PubChemData

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CC[C@@H](C)NC(=O)O[C@@H](C)C1=CC=CC=C1

DOS

IR

Vibrations