Geometry & MOs

Info

ID:	58472
PubChem CID:	24701974
Reduced:	F2N2O2H12C15 (1)
Stoich.:	A2B2C2D12E15 (1)
Weight, g/mol:	249.111341
ΔH_f, kcal/mol:	-93.8
Dipole, Da:	2.16
IP(EA), eV:	-9.07(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(pyrazine-2-carbonylamino)cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

C/C(=N\O)/C1=CC=CC=C1NC(=O)C2=C(C=C(C=C2)F)F

DOS

IR

Vibrations