Geometry & MOs

Info

ID:	374728
PubChem CID:	131342557
Reduced:	N2O3C10H12 (1)
Stoich.:	A2B3C10D12 (1)
Weight, g/mol:	208.084792
ΔH_f, kcal/mol:	-57.97
Dipole, Da:	4.42
IP(EA), eV:	-11.06(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-ethylpyrazin-2-yl)oxetane-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=NO1)C(C)C#N)C(=O)O

DOS

IR

Vibrations