Geometry & MOs

Info

ID:	200347
PubChem CID:	79376468
Reduced:	N2O3C12H18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	262.142976
ΔH_f, kcal/mol:	-125.04
Dipole, Da:	4.49
IP(EA), eV:	-9.57(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-ethyl-2-methylpyrazol-3-yl)methyl]-2-methoxy-6-methylpyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=CC(=O)N(C(=N1)OC)CC2CCCCO2

DOS

IR

Vibrations