Geometry & MOs

Info

ID:	264237
PubChem CID:	103445013
Reduced:	ClSN3C11H12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	223.014854
ΔH_f, kcal/mol:	58.16
Dipole, Da:	2.11
IP(EA), eV:	-8.91(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloropyridin-2-yl)-1H-imidazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC(C1=CSC(=N1)C2=C(C=CC=N2)Cl)NC

DOS

IR

Vibrations