Geometry & MOs

Info

ID:	257802
PubChem CID:	103148635
Reduced:	OSF3N3C13H18 (1)
Stoich.:	ABC3D3E13F18 (1)
Weight, g/mol:	311.243599
ΔH_f, kcal/mol:	-157.45
Dipole, Da:	4.07
IP(EA), eV:	-8.85(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(2,2,2-trifluoroethoxy)dodecan-3-amine

Drug info:

PubChemData

Smile

CCNC(CCOCC(F)(F)F)CC1=CN2C=CSC2=N1

DOS

IR

Vibrations