Geometry & MOs

Info

ID:	421956
PubChem CID:	135116910
Reduced:	SN3O5C15H25 (1)
Stoich.:	AB3C5D15E25 (1)
Weight, g/mol:	393.135842
ΔH_f, kcal/mol:	-172.84
Dipole, Da:	5.04
IP(EA), eV:	-8.93(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-4-methoxyquinoline-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1CN(C[C@@H]1O)CC2=NC=CC(=C2OC)OC

DOS

IR

Vibrations