Geometry & MOs

Info

ID:	311834
PubChem CID:	126598129
Reduced:	INH8C9 (1)
Stoich.:	ABC8D9 (1)
Weight, g/mol:	164.040819
ΔH_f, kcal/mol:	48.69
Dipole, Da:	2.97
IP(EA), eV:	-8.36(-2.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-sulfanylpyrrolo[2,3-b]pyridine

Drug info:

PubChemData

Smile

CC1=CC2=CC=CC=C2N1I

DOS

IR

Vibrations