Geometry & MOs

Info

ID:	143854
PubChem CID:	53269662
Reduced:	ClON2C11H11 (1)
Stoich.:	ABC2D11E11 (1)
Weight, g/mol:	382.018839
ΔH_f, kcal/mol:	-8.0
Dipole, Da:	2.77
IP(EA), eV:	-9.4(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCC(C(=O)C1=CNC2=C1C=CC=N2)Cl

DOS

IR

Vibrations