Geometry & MOs

Info

ID:	236253
PubChem CID:	92712076
Reduced:	N3O3C20H25 (1)
Stoich.:	A3B3C20D25 (1)
Weight, g/mol:	406.063269
ΔH_f, kcal/mol:	-81.95
Dipole, Da:	3.97
IP(EA), eV:	-8.31(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]butanamide

Drug info:

PubChemData

Smile

CC1=CC=C2N1CCN([C@@H]2C(C)C)C(=O)NC3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations