Geometry & MOs

Info

ID:	180801
PubChem CID:	76688308
Reduced:	NO4C12H21 (1)
Stoich.:	AB4C12D21 (1)
Weight, g/mol:	308.214016
ΔH_f, kcal/mol:	-206.32
Dipole, Da:	4.98
IP(EA), eV:	-10.13(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6,6-trimethyl-1,1-diphenylheptan-4-one

Drug info:

PubChemData

Smile

CCC(C)C(=O)NC(C1CCOCC1)C(=O)O

DOS

IR

Vibrations