Geometry & MOs

Info

ID:	264624
PubChem CID:	103476964
Reduced:	O2F3N3C12H18 (1)
Stoich.:	A2B3C3D12E18 (1)
Weight, g/mol:	171.087098
ΔH_f, kcal/mol:	-235.74
Dipole, Da:	7.44
IP(EA), eV:	-9.56(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)NCC1=CC(=O)N=C(N1)COCC(F)(F)F

DOS

IR

Vibrations