Geometry & MOs

Info

ID:	384000
PubChem CID:	134976145
Reduced:	OC7H7 (2)
Stoich.:	AB7C7 (2)
Weight, g/mol:	290.10955
ΔH_f, kcal/mol:	31.69
Dipole, Da:	2.41
IP(EA), eV:	-9.46(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z,17Z)-tricyclo[17.2.2.08,12]tricosa-1(22),2,8(12),17,19(23),20-hexaen-4,6,13,15-tetrayne

Drug info:

PubChemData

Smile

C=C[C@@H]1C#CC2=CCCC2(CC#C[C@@H]1O)O

DOS

IR

Vibrations