Geometry & MOs

Info

ID:	260039
PubChem CID:	103179319
Reduced:	NO2C7H12 (2)
Stoich.:	AB2C7D12 (2)
Weight, g/mol:	243.144613
ΔH_f, kcal/mol:	-161.82
Dipole, Da:	3.87
IP(EA), eV:	-8.29(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,4-trifluoro-N-[2-(3-methoxypropoxy)ethyl]butan-1-amine

Drug info:

PubChemData

Smile

CCCN1C=C(C=C1C(=O)OCCOCCCOC)N

DOS

IR

Vibrations