Geometry & MOs

Info

ID:	385188
PubChem CID:	134978480
Reduced:	OH12C14 (2)
Stoich.:	AB12C14 (2)
Weight, g/mol:	318.237892
ΔH_f, kcal/mol:	69.38
Dipole, Da:	2.76
IP(EA), eV:	-9.35(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CCC(=O)C2/C(=C\C1)/C3(C4=CC=CC=C4C2(O3)C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations