Geometry & MOs

Info

ID:	328520
PubChem CID:	126724124
Reduced:	ClON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	761.108144
ΔH_f, kcal/mol:	-51.36
Dipole, Da:	3.23
IP(EA), eV:	-8.94(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-nitro-4,5-bis(4,4,5,5,6,6,7,7,7-nonafluoroheptoxy)phenyl]ethyl acetate

Drug info:

PubChemData

Smile

C[C@@H]1CCN(C1)CCNC(=O)C2=C(C=CC=C2Cl)C

DOS

IR

Vibrations