Geometry & MOs

Info

ID:	308467
PubChem CID:	125333179
Reduced:	ON2C4H4 (3)
Stoich.:	AB2C4D4 (3)
Weight, g/mol:	288.097088
ΔH_f, kcal/mol:	-2.85
Dipole, Da:	4.62
IP(EA), eV:	-9.72(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-benzylideneamino]-2-[[(6S)-3,5-dioxo-6H-1,2,4-triazin-6-yl]amino]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=N\NC(=O)CN[C@H]2C(=O)NC(=O)N=N2

DOS

IR

Vibrations