Geometry & MOs

Info

ID:	171531
PubChem CID:	75389606
Reduced:	O2N5C18H19 (1)
Stoich.:	A2B5C18D19 (1)
Weight, g/mol:	327.016592
ΔH_f, kcal/mol:	6.46
Dipole, Da:	6.23
IP(EA), eV:	-9.08(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-fluorophenyl)-N-(2-methylsulfinylpropyl)methanesulfonamide

Drug info:

PubChemData

Smile

CC1=C(N=C(N1)C2=CC(=CC=C2)OC)C(=O)N3CCC4=C(C3)C=NN4

DOS

IR

Vibrations