Geometry & MOs

Info

ID:	245740
PubChem CID:	103023171
Reduced:	FN3C13H20 (1)
Stoich.:	AB3C13D20 (1)
Weight, g/mol:	260.037085
ΔH_f, kcal/mol:	-30.15
Dipole, Da:	2.7
IP(EA), eV:	-9.1(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CCC2(CC3CCC(C2)N3)F

DOS

IR

Vibrations