Geometry & MOs

Info

ID:	47840
PubChem CID:	10535586
Reduced:	N3C11H13 (1)
Stoich.:	A3B11C13 (1)
Weight, g/mol:	187.0667
ΔH_f, kcal/mol:	43.42
Dipole, Da:	6.54
IP(EA), eV:	-8.66(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-methyl-3-methylsulfonylpyrrole

Drug info:

PubChemData

Smile

CC1=NC2=C(N1C)C=C3CCCC3=N2

DOS

IR

Vibrations