Geometry & MOs

Info

ID:	27229
PubChem CID:	819796
Reduced:	ClN4H5C6 (1)
Stoich.:	AB4C5D6 (1)
Weight, g/mol:	218.990948
ΔH_f, kcal/mol:	87.39
Dipole, Da:	5.44
IP(EA), eV:	-9.95(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-[1]benzothiolo[3,2-c]pyridine

Drug info:

PubChemData

Smile

CC1=CC2=NN=CN2N=C1Cl

DOS

IR

Vibrations