Geometry & MOs

Info

ID:	205709
PubChem CID:	80138486
Reduced:	OSN3C7H11 (1)
Stoich.:	ABC3D7E11 (1)
Weight, g/mol:	233.12766
ΔH_f, kcal/mol:	-7.62
Dipole, Da:	1.97
IP(EA), eV:	-8.34(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-amine

Drug info:

PubChemData

Smile

CCSC1=NC=NC(=C1N)OC

DOS

IR

Vibrations