Geometry & MOs

Info

ID:	184691
PubChem CID:	77192927
Reduced:	ClF3N3O4H19C21 (1)
Stoich.:	AB3C3D4E19F21 (1)
Weight, g/mol:	475.511701
ΔH_f, kcal/mol:	-244.54
Dipole, Da:	11.74
IP(EA), eV:	-9.83(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-nonacos-20-en-10-ylpyrrolidine

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)C(=O)O)NC(=O)C2=C(N(N=C2C(F)(F)F)C)OC3=CC=CC(C3)Cl

DOS

IR

Vibrations