Geometry & MOs

Info

ID:	137181
PubChem CID:	52167503
Reduced:	O2N6C17H20 (1)
Stoich.:	A2B6C17D20 (1)
Weight, g/mol:	306.180424
ΔH_f, kcal/mol:	10.11
Dipole, Da:	1.67
IP(EA), eV:	-8.73(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-diethyl-6-[(1,3,5-trimethylpyrazol-4-yl)methylamino]-1,2,4-triazine-3,5-dione

Drug info:

PubChemData

Smile

CCN1C(=O)C(=NN(C1=O)CC)NC2=CC=CC(=C2)CN3C=CC=N3

DOS

IR

Vibrations