Geometry & MOs

Info

ID:	414806
PubChem CID:	135087769
Reduced:	ClFSN2O5C15H20 (1)
Stoich.:	ABCD2E5F15G20 (1)
Weight, g/mol:	378.081634
ΔH_f, kcal/mol:	-236.84
Dipole, Da:	6.35
IP(EA), eV:	-9.28(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-4-fluorophenyl)-N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]acetamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@H]1NC(=O)COC2=CC(=C(C=C2)F)Cl

DOS

IR

Vibrations