Geometry & MOs

Info

ID:	38225
PubChem CID:	8028190
Reduced:	N2S2O3C12H12 (1)
Stoich.:	A2B2C3D12E12 (1)
Weight, g/mol:	353.126323
ΔH_f, kcal/mol:	-69.81
Dipole, Da:	4.96
IP(EA), eV:	-9.41(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[(2R)-2-hydroxy-2-phenylethyl]-2-(2-oxochromen-7-yl)oxypropanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NS(=O)(=O)C2=CSC(=C2)C(=O)N

DOS

IR

Vibrations