Geometry & MOs

Info

ID:	245736
PubChem CID:	103023154
Reduced:	FN3C11H18 (1)
Stoich.:	AB3C11D18 (1)
Weight, g/mol:	220.14633
ΔH_f, kcal/mol:	-29.35
Dipole, Da:	3.43
IP(EA), eV:	-9.18(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dimethylphenyl)-3-methoxy-3-methylbutan-1-one

Drug info:

PubChemData

Smile

CN1C(=CC=N1)CCC2(CCNCC2)F

DOS

IR

Vibrations