Geometry & MOs

Info

ID:	292507
PubChem CID:	115001673
Reduced:	NOC13H29 (1)
Stoich.:	ABC13D29 (1)
Weight, g/mol:	216.097329
ΔH_f, kcal/mol:	-92.77
Dipole, Da:	2.66
IP(EA), eV:	-8.73(2.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-5-(2,2,2-trifluoroethoxy)pentan-3-ol

Drug info:

PubChemData

Smile

CCCCOCCC(CCC(C)C)NC

DOS

IR

Vibrations