Geometry & MOs

Info

ID:	380137
PubChem CID:	134965122
Reduced:	NOF3H8C12 (1)
Stoich.:	ABC3D8E12 (1)
Weight, g/mol:	250.135765
ΔH_f, kcal/mol:	-127.26
Dipole, Da:	0.34
IP(EA), eV:	-9.37(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-(2-methylphenyl)-3,4-dihydronaphthalen-1-one

Drug info:

PubChemData

Smile

COC1=CC=CC(=N1)C2=C(C=C(C=C2F)F)F

DOS

IR

Vibrations