Geometry & MOs

Info

ID:	58538
PubChem CID:	24702269
Reduced:	OSN3C9H11 (1)
Stoich.:	ABC3D9E11 (1)
Weight, g/mol:	261.108897
ΔH_f, kcal/mol:	-2.1
Dipole, Da:	4.56
IP(EA), eV:	-8.7(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-3-[N-(2,2,2-trifluoroethyl)anilino]propanimidamide

Drug info:

PubChemData

Smile

C1C(NCS1)C(=O)NC2=CC=CC=N2

DOS

IR

Vibrations