Geometry & MOs

Info

ID:	337018
PubChem CID:	127256583
Reduced:	NO2C8H13 (1)
Stoich.:	AB2C8D13 (1)
Weight, g/mol:	247.045628
ΔH_f, kcal/mol:	-26.97
Dipole, Da:	1.89
IP(EA), eV:	-11.29(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z,5E,7Z)-azonin-2-one;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CCCCCOC(=O)C1=NC1

DOS

IR

Vibrations