Geometry & MOs

Info

ID:	257831
PubChem CID:	103148742
Reduced:	NOSF3C13H20 (1)
Stoich.:	ABCD3E13F20 (1)
Weight, g/mol:	311.130855
ΔH_f, kcal/mol:	-204.31
Dipole, Da:	4.36
IP(EA), eV:	-8.97(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-difluorophenyl)-N-propyl-3-(2,2,2-trifluoroethoxy)propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CCOCC(F)(F)F)C1=CSC(=C1)C

DOS

IR

Vibrations