Geometry & MOs

Info

ID:	224281
PubChem CID:	85341066
Reduced:	OC4H5 (4)
Stoich.:	AB4C5 (4)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	-160.89
Dipole, Da:	4.85
IP(EA), eV:	-9.54(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethoxy-4-[(4-methoxyphenyl)methyl]-2-methyl-2,5-dihydropyrazin-3-one

Drug info:

PubChemData

Smile

CCC1C(C(=O)CC12OCCO2)C(C3=CC=CC=C3)O

DOS

IR

Vibrations