Geometry & MOs

Info

ID:	200278
PubChem CID:	79375932
Reduced:	N3O3C13H19 (1)
Stoich.:	A3B3C13D19 (1)
Weight, g/mol:	222.07529
ΔH_f, kcal/mol:	-96.26
Dipole, Da:	4.8
IP(EA), eV:	-9.46(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-6-methyl-3-(1,2,4-oxadiazol-3-ylmethyl)pyrimidin-4-one

Drug info:

PubChemData

Smile

CCN(C1CC1)C(=O)CN2C(=O)C=C(N=C2OC)C

DOS

IR

Vibrations