Geometry & MOs

Info

ID:	135511
PubChem CID:	51883233
Reduced:	SN2O4C19H28 (1)
Stoich.:	AB2C4D19E28 (1)
Weight, g/mol:	432.113076
ΔH_f, kcal/mol:	-150.7
Dipole, Da:	4.53
IP(EA), eV:	-9.23(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-4-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

C[C@@H]1CCCC[C@H]1NC(=O)CN(CC=C)S(=O)(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations