Geometry & MOs

Info

ID:	58461
PubChem CID:	24701896
Reduced:	SO2N3C7H11 (1)
Stoich.:	AB2C3D7E11 (1)
Weight, g/mol:	244.067034
ΔH_f, kcal/mol:	-46.93
Dipole, Da:	4.16
IP(EA), eV:	-9.11(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(pyridin-3-ylmethoxy)benzenecarbothioamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CN)NS(=O)(=O)N

DOS

IR

Vibrations