Geometry & MOs

Info

ID:	69849
PubChem CID:	47205551
Reduced:	SN3O3C12H15 (1)
Stoich.:	AB3C3D12E15 (1)
Weight, g/mol:	243.056529
ΔH_f, kcal/mol:	-83.6
Dipole, Da:	4.98
IP(EA), eV:	-9.18(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyphenyl)-2-methylsulfonylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CN2C=CC=CC2=N1)S(=O)(=O)C

DOS

IR

Vibrations