Geometry & MOs

Info

ID:	245853
PubChem CID:	103024430
Reduced:	O2C13H24 (1)
Stoich.:	A2B13C24 (1)
Weight, g/mol:	212.102414
ΔH_f, kcal/mol:	-128.61
Dipole, Da:	2.97
IP(EA), eV:	-9.56(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoro-6-methoxy-6-methylheptan-3-one

Drug info:

PubChemData

Smile

CC(C)(CCC(=O)C1CCCCC1)OC

DOS

IR

Vibrations