Geometry & MOs

Info

ID:	32721
PubChem CID:	7847329
Reduced:	ClNF2O4H12C16 (1)
Stoich.:	ABC2D4E12F16 (1)
Weight, g/mol:	339.123736
ΔH_f, kcal/mol:	-204.66
Dipole, Da:	4.97
IP(EA), eV:	-9.32(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(cycloheptylamino)-2-oxoethyl] 2-(2-chlorophenoxy)acetate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)OCC(=O)OCC(=O)NC2=C(C=C(C=C2)F)F)Cl

DOS

IR

Vibrations