Geometry & MOs

Info

ID:	337275
PubChem CID:	127256957
Reduced:	NSO4C14H19 (1)
Stoich.:	ABC4D14E19 (1)
Weight, g/mol:	239.076928
ΔH_f, kcal/mol:	-152.26
Dipole, Da:	4.35
IP(EA), eV:	-9.15(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,3,3-trifluoro-2-oxopropyl) piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CC(OC(=O)C1CCCNC1)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations