Geometry & MOs

Info

ID:	160075
PubChem CID:	57304617
Reduced:	N2C9H14 (1)
Stoich.:	A2B9C14 (1)
Weight, g/mol:	354.140199
ΔH_f, kcal/mol:	14.49
Dipole, Da:	1.27
IP(EA), eV:	-9.97(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-cyclopentyloxy-4-methoxyphenyl)-5-methyl-5H-pyrrolo[3,4-b]pyridine-7-thione

Drug info:

PubChemData

Smile

CC(C)CCC1=NC=CC=N1

DOS

IR

Vibrations