Geometry & MOs

Info

ID:	250168
PubChem CID:	103094602
Reduced:	ClN2O3H7C9 (1)
Stoich.:	AB2C3D7E9 (1)
Weight, g/mol:	180.045426
ΔH_f, kcal/mol:	-81.59
Dipole, Da:	1.56
IP(EA), eV:	-9.84(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-2-(2,5-dihydropyrrol-1-yl)pyridine

Drug info:

PubChemData

Smile

C1C(=O)N(C(=O)CO1)C2=C(C=CC=N2)Cl

DOS

IR

Vibrations