Geometry & MOs

Info

ID:	337351
PubChem CID:	127257036
Reduced:	SN2O3C12H12 (1)
Stoich.:	AB2C3D12E12 (1)
Weight, g/mol:	326.072513
ΔH_f, kcal/mol:	-66.14
Dipole, Da:	4.66
IP(EA), eV:	-8.65(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-6-phenylphenyl) pyridine-3-sulfonate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)N)OS(=O)(=O)C2=CN=CC=C2

DOS

IR

Vibrations