Geometry & MOs

Info

ID:	420555
PubChem CID:	135113872
Reduced:	O3N4C20H22 (1)
Stoich.:	A3B4C20D22 (1)
Weight, g/mol:	364.065984
ΔH_f, kcal/mol:	-62.33
Dipole, Da:	4.44
IP(EA), eV:	-8.92(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-3-fluorobenzamide

Drug info:

PubChemData

Smile

C1CC2(CCC3=CN=C(N=C32)N)CN(C1)C(=O)C4=C5C(=CC=C4)OCCO5

DOS

IR

Vibrations