Geometry & MOs

Info

ID:	372639
PubChem CID:	131301318
Reduced:	ClSN3O4H6C8 (1)
Stoich.:	ABC3D4E6F8 (1)
Weight, g/mol:	270.99784
ΔH_f, kcal/mol:	-16.67
Dipole, Da:	9.34
IP(EA), eV:	-10.69(-2.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-amino-2,2-difluoro-3-hydroxypropyl)-3,5-dichlorophenol

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1C#N)[N+](=O)[O-])S(=O)(=O)Cl)CN

DOS

IR

Vibrations