Geometry & MOs

Info

ID:	261598
PubChem CID:	103241627
Reduced:	O3N4C14H18 (1)
Stoich.:	A3B4C14D18 (1)
Weight, g/mol:	184.084792
ΔH_f, kcal/mol:	-42.11
Dipole, Da:	8.6
IP(EA), eV:	-9.6(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-methoxypropan-2-yloxy)-1H-pyrazin-2-one

Drug info:

PubChemData

Smile

COCC1=CC=CC(=C1)CNCCN2C=C(N=N2)C(=O)O

DOS

IR

Vibrations