Geometry & MOs

Info

ID:	17819
PubChem CID:	521947
Reduced:	NOC6H7 (1)
Stoich.:	ABC6D7 (1)
Weight, g/mol:	109.052764
ΔH_f, kcal/mol:	-18.32
Dipole, Da:	3.04
IP(EA), eV:	-9.37(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-pyrrol-1-ylethanone

Drug info:

PubChemData

Smile

CC(=O)N1C=CC=C1

DOS

IR

Vibrations