Geometry & MOs

Info

ID:	257793
PubChem CID:	103148620
Reduced:	NO2F3C12H24 (1)
Stoich.:	AB2C3D12E24 (1)
Weight, g/mol:	293.171497
ΔH_f, kcal/mol:	-276.26
Dipole, Da:	4.5
IP(EA), eV:	-8.95(1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC(CCOCC(F)(F)F)C(C)CCOC

DOS

IR

Vibrations