Geometry & MOs

Info

ID:	446536
PubChem CID:	135275754
Reduced:	NO3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	155.058243
ΔH_f, kcal/mol:	-84.17
Dipole, Da:	8.12
IP(EA), eV:	-8.99(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-hydroxy-4-methyl-1H-pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CCCN(CC)C1=CC(=O)C2=C(O1)C(=CO2)C

DOS

IR

Vibrations