Geometry & MOs

Info

ID:	418270
PubChem CID:	135104034
Reduced:	SN3O3C18H21 (1)
Stoich.:	AB3C3D18E21 (1)
Weight, g/mol:	372.135508
ΔH_f, kcal/mol:	-63.64
Dipole, Da:	6.33
IP(EA), eV:	-8.37(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-(3-methoxyphenoxy)acetamide

Drug info:

PubChemData

Smile

COC1=CC(=CC=C1)SCC(=O)N2C[C@H]([C@@H](C2)O)CC3=NC=CN=C3

DOS

IR

Vibrations