Geometry & MOs

Info

ID:	146944
PubChem CID:	53775618
Reduced:	ClSO2N3H16C21 (1)
Stoich.:	ABC2D3E16F21 (1)
Weight, g/mol:	160.051128
ΔH_f, kcal/mol:	36.53
Dipole, Da:	5.06
IP(EA), eV:	-9.3(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-3-(2,2,2-trifluoroethoxy)propane

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C3=CN=CC=C3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations