Geometry & MOs

Info

ID:	385987
PubChem CID:	134980474
Reduced:	H12C13 (2)
Stoich.:	A12B13 (2)
Weight, g/mol:	336.187801
ΔH_f, kcal/mol:	87.63
Dipole, Da:	0.92
IP(EA), eV:	-9.03(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,5S,6S)-6-methyl-3-methylidene-1,2,5-triphenylbicyclo[3.1.0]hexane

Drug info:

PubChemData

Smile

C[C@@]12C/C(=C/C3=CC=CC=C3)/C[C@@]1([C@H]2C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations