Geometry & MOs

Info

ID:	257730
PubChem CID:	103148397
Reduced:	OSN2F3C10H15 (1)
Stoich.:	ABC2D3E10F15 (1)
Weight, g/mol:	279.155847
ΔH_f, kcal/mol:	-177.52
Dipole, Da:	5.42
IP(EA), eV:	-9.36(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethylpyrazol-3-yl)-N-methyl-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CNC(CCOCC(F)(F)F)CC1=CN=CS1

DOS

IR

Vibrations