Geometry & MOs

Info

ID:	26206
PubChem CID:	641070
Reduced:	ClSN2O3H15C18 (1)
Stoich.:	ABC2D3E15F18 (1)
Weight, g/mol:	176.058578
ΔH_f, kcal/mol:	-49.98
Dipole, Da:	4.07
IP(EA), eV:	-8.93(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde

Drug info:

PubChemData

Smile

COC1=NC2=C(C3=C1CSCC3)C(=C(O2)C(=O)C4=CC=C(C=C4)Cl)N

DOS

IR

Vibrations