Geometry & MOs

Info

ID:	404756
PubChem CID:	135070524
Reduced:	ClO3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	294.198365
ΔH_f, kcal/mol:	-120.12
Dipole, Da:	2.37
IP(EA), eV:	-9.54(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1,3-diphenyloctan-1-one

Drug info:

PubChemData

Smile

CCOC(=O)C(=O)CC(C)C1=CC=C(C=C1)Cl

DOS

IR

Vibrations