Geometry & MOs

Info

ID:	65249
PubChem CID:	29204667
Reduced:	N2S2F3O6C18H19 (1)
Stoich.:	A2B2C3D6E18F19 (1)
Weight, g/mol:	480.063663
ΔH_f, kcal/mol:	-368.68
Dipole, Da:	11.64
IP(EA), eV:	-9.0(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(benzenesulfonamido)-4-methylsulfonyl-N-[4-(trifluoromethoxy)phenyl]butanamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CC[C@H](C(=O)NC1=CC=C(C=C1)OC(F)(F)F)NS(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations