Geometry & MOs

Info

ID:	242817
PubChem CID:	99213171
Reduced:	SN2F3O4C20H21 (1)
Stoich.:	AB2C3D4E20F21 (1)
Weight, g/mol:	442.117413
ΔH_f, kcal/mol:	-221.93
Dipole, Da:	4.05
IP(EA), eV:	-9.94(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-4-(methoxysulfamoyl)-N-[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]benzamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=CC=C1)C(F)(F)F)N(C2CC2)C(=O)C3=CC=C(O3)S(=O)(=O)NC4CC4

DOS

IR

Vibrations