Geometry & MOs

Info

ID:	13704
PubChem CID:	397064
Reduced:	ON8C11H18 (1)
Stoich.:	AB8C11D18 (1)
Weight, g/mol:	278.160357
ΔH_f, kcal/mol:	54.84
Dipole, Da:	7.39
IP(EA), eV:	-8.59(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-amino-6-(3,5,5-trimethyl-4H-pyrazol-1-yl)-1,3,5-triazin-2-yl]-N'-hydroxyethanimidamide

Drug info:

PubChemData

Smile

CC1=NN(C(C1)(C)C)C2=NC(=NC(=N2)N)CC(=NO)N

DOS

IR

Vibrations