Geometry & MOs

Info

ID:	257796
PubChem CID:	103148623
Reduced:	N2O2F3C14H21 (1)
Stoich.:	A2B2C3D14E21 (1)
Weight, g/mol:	269.196649
ΔH_f, kcal/mol:	-225.14
Dipole, Da:	4.45
IP(EA), eV:	-9.23(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-7-methyl-1-(2,2,2-trifluoroethoxy)octan-3-amine

Drug info:

PubChemData

Smile

CCNC(CCOCC(F)(F)F)C1=CC(=CN=C1)OCC

DOS

IR

Vibrations