Geometry & MOs

Info

ID:	393986
PubChem CID:	135022089
Reduced:	O10C15H26 (1)
Stoich.:	A10B15C26 (1)
Weight, g/mol:	314.203451
ΔH_f, kcal/mol:	-360.19
Dipole, Da:	5.42
IP(EA), eV:	-9.94(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexacyclo[13.7.1.14,8.02,13.019,23.012,24]tetracosa-2,4,6,13,15,17-hexaene

Drug info:

PubChemData

Smile

C[C@@]1(C2C(C(C3(C(C(C(C(C3(C2O)O1)(C)O)O)O)O)CO)O)O)CO

DOS

IR

Vibrations