Geometry & MOs

Info

ID:	294097
PubChem CID:	117427086
Reduced:	ClN3O4H8C10 (1)
Stoich.:	AB3C4D8E10 (1)
Weight, g/mol:	269.043041
ΔH_f, kcal/mol:	-45.37
Dipole, Da:	5.58
IP(EA), eV:	-8.93(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-[2-[5-chloro-4-methoxy-2-(trifluoromethyl)phenyl]ethyl]hydroxylamine

Drug info:

PubChemData

Smile

C1OC2=C/C(=C/3\NOC(=N3)CN)/C(=O)C(=C2O1)Cl

DOS

IR

Vibrations