Geometry & MOs

Info

ID:	229960
PubChem CID:	87569657
Reduced:	SF3N3O6H32C33 (1)
Stoich.:	AB3C3D6E32F33 (1)
Weight, g/mol:	213.03567
ΔH_f, kcal/mol:	-300.21
Dipole, Da:	7.17
IP(EA), eV:	-8.58(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-(2-chloro-2-fluoroethenyl)phenyl]ethylidene]hydroxylamine

Drug info:

PubChemData

Smile

CN(C)C(CNC(=O)C(F)(F)F)C1(CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C4=CC=CC=C43)OC)C(=O)OCC5=CC=CC=C5

DOS

IR

Vibrations