Geometry & MOs

Info

ID:	44363
PubChem CID:	10503146
Reduced:	ClNF2O3C23H26 (1)
Stoich.:	ABC2D3E23F26 (1)
Weight, g/mol:	317.121141
ΔH_f, kcal/mol:	-199.29
Dipole, Da:	9.07
IP(EA), eV:	-8.75(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CC(C[NH+](C1)CCOCC=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(=O)O.[Cl-]

DOS

IR

Vibrations