Geometry & MOs

Info

ID:	372316
PubChem CID:	131296133
Reduced:	N2O2C3H4 (2)
Stoich.:	A2B2C3D4 (2)
Weight, g/mol:	330.9681
ΔH_f, kcal/mol:	-81.24
Dipole, Da:	9.08
IP(EA), eV:	-10.44(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S)-1-amino-3,3,3-trifluoropropyl]-4-iodophenol

Drug info:

PubChemData

Smile

CNC1=C(C(=O)NC(=O)N1C)[N+](=O)[O-]

DOS

IR

Vibrations