Geometry & MOs

Info

ID:	372501
PubChem CID:	131298854
Reduced:	ON2C5H5 (2)
Stoich.:	AB2C5D5 (2)
Weight, g/mol:	239.071306
ΔH_f, kcal/mol:	-2.37
Dipole, Da:	4.93
IP(EA), eV:	-8.85(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chloropyridin-2-yl)cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

COC(=O)C1=CN(N=C1)C2=C(C=CC=N2)N

DOS

IR

Vibrations