Geometry & MOs

Info

ID:	282082
PubChem CID:	103915458
Reduced:	N2F3O5C9H9 (1)
Stoich.:	A2B3C5D9E9 (1)
Weight, g/mol:	406.93969
ΔH_f, kcal/mol:	-249.34
Dipole, Da:	4.25
IP(EA), eV:	-10.41(-1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(2-hydroxyethyl)-2-iodo-N-(2,2,2-trifluoroethyl)benzamide

Drug info:

PubChemData

Smile

C1=C(OC(=C1)[N+](=O)[O-])C(=O)N(CCO)CC(F)(F)F

DOS

IR

Vibrations