Geometry & MOs

Info

ID:	15418
PubChem CID:	440911
Reduced:	C5H8 (4)
Stoich.:	A5B8 (4)
Weight, g/mol:	272.250401
ΔH_f, kcal/mol:	-41.58
Dipole, Da:	1.17
IP(EA), eV:	-9.54(1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,9R,10R,13R)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane

Drug info:

PubChemData

Smile

C[C@@]12CCCC([C@H]1CCC34[C@H]2CC[C@H](C3)C(=C)C4)(C)C

DOS

IR

Vibrations