Geometry & MOs

Info

ID:	385990
PubChem CID:	134980481
Reduced:	C21H26 (1)
Stoich.:	A21B26 (1)
Weight, g/mol:	336.187801
ΔH_f, kcal/mol:	18.17
Dipole, Da:	0.23
IP(EA), eV:	-8.74(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,5S)-3-benzylidene-6-methyl-1,5-diphenylbicyclo[3.1.0]hexane

Drug info:

PubChemData

Smile

CCC1C(C1(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C)(C)C

DOS

IR

Vibrations