Geometry & MOs

Info

ID:	53155
PubChem CID:	14709676
Reduced:	NOSC9H11 (1)
Stoich.:	ABCD9E11 (1)
Weight, g/mol:	189.061221
ΔH_f, kcal/mol:	15.04
Dipole, Da:	0.64
IP(EA), eV:	-8.66(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylsulfanylphenyl)-1H-pyrrole

Drug info:

PubChemData

Smile

C/C(=N\O)/C1=CC=C(C=C1)SC

DOS

IR

Vibrations