Geometry & MOs

Info

ID:	176118
PubChem CID:	75998578
Reduced:	N4O4C19H22 (1)
Stoich.:	A4B4C19D22 (1)
Weight, g/mol:	293.094646
ΔH_f, kcal/mol:	-59.63
Dipole, Da:	8.64
IP(EA), eV:	-9.84(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-ethyloxadiazol-3-ium-5-yl)ethanimidate

Drug info:

PubChemData

Smile

CN1C(=CC(=NC(=O)C2=CC=CC=C2)C(=O)NC3CCCCC3)C(=O)ON1

DOS

IR

Vibrations