Geometry & MOs

Info

ID:	197758
PubChem CID:	78991871
Reduced:	SF3O5C9H13 (1)
Stoich.:	AB3C5D9E13 (1)
Weight, g/mol:	269.152812
ΔH_f, kcal/mol:	-384.04
Dipole, Da:	3.12
IP(EA), eV:	-11.03(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-2-[[[(1R)-1-phenylethyl]amino]methyl]benzenecarboximidamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CC1(CCOCC(F)(F)F)C(=O)O

DOS

IR

Vibrations