Geometry & MOs

Info

ID:	399787
PubChem CID:	135042671
Reduced:	O3C15H20 (1)
Stoich.:	A3B15C20 (1)
Weight, g/mol:	264.151415
ΔH_f, kcal/mol:	-118.94
Dipole, Da:	5.15
IP(EA), eV:	-9.97(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,4S)-4-methyl-4,6-diphenylhex-5-en-2-one

Drug info:

PubChemData

Smile

C/C/1=C\CCC2=C[C@@H](C(CCC1=O)(C)C)OC2=O

DOS

IR

Vibrations