Geometry & MOs

Info

ID:	257839
PubChem CID:	103148777
Reduced:	NOF3C14H28 (1)
Stoich.:	ABC3D14E28 (1)
Weight, g/mol:	313.116874
ΔH_f, kcal/mol:	-255.29
Dipole, Da:	2.87
IP(EA), eV:	-8.88(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chloro-2-methylpyrazol-3-yl)-N-propyl-3-(2,2,2-trifluoroethoxy)propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CCCC(C)C)CCOCC(F)(F)F

DOS

IR

Vibrations