Geometry & MOs

Info

ID:	182474
PubChem CID:	76891889
Reduced:	OSN2F3C13H17 (1)
Stoich.:	ABC2D3E13F17 (1)
Weight, g/mol:	260.113648
ΔH_f, kcal/mol:	-189.22
Dipole, Da:	2.8
IP(EA), eV:	-8.8(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3,3-dimethyl-N-(2,3,4-trifluorophenyl)butanamide

Drug info:

PubChemData

Smile

CSCCC(C(=O)NCC1=CC(=CC=C1)C(F)(F)F)N

DOS

IR

Vibrations