Geometry & MOs

Info

ID:	257803
PubChem CID:	103148640
Reduced:	NOF3C16H32 (1)
Stoich.:	ABC3D16E32 (1)
Weight, g/mol:	279.155847
ΔH_f, kcal/mol:	-267.55
Dipole, Da:	3.97
IP(EA), eV:	-9.02(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(1-methylpyrazol-4-yl)-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CCCCCCCCCC(CCOCC(F)(F)F)NCC

DOS

IR

Vibrations