Geometry & MOs

Info

ID:	293175
PubChem CID:	117375859
Reduced:	NSO3H11C12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	249.063506
ΔH_f, kcal/mol:	-68.66
Dipole, Da:	3.56
IP(EA), eV:	-9.01(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-difluoro-4-methylsulfonylphenyl)propan-1-amine

Drug info:

PubChemData

Smile

CCOC(=O)C(=O)C1=CC2=C(C=C1)C(=NS2)C

DOS

IR

Vibrations