Geometry & MOs

Info

ID:	259281
PubChem CID:	103162399
Reduced:	NOC15H17 (1)
Stoich.:	ABC15D17 (1)
Weight, g/mol:	207.089543
ΔH_f, kcal/mol:	-1.1
Dipole, Da:	6.25
IP(EA), eV:	-8.62(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclobutylacetyl)-1H-pyrrole-2-carboxylic acid

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)C(=O)CC3CCC3

DOS

IR

Vibrations