Geometry & MOs

Info

ID:	20833
PubChem CID:	586017
Reduced:	NO3C9H11 (1)
Stoich.:	AB3C9D11 (1)
Weight, g/mol:	181.073893
ΔH_f, kcal/mol:	-110.08
Dipole, Da:	6.13
IP(EA), eV:	-9.48(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-formyl-5-methyl-1H-pyrrole-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CNC(=C1C=O)C

DOS

IR

Vibrations