Geometry & MOs

Info

ID:	12724
PubChem CID:	144574
Reduced:	C13H22 (1)
Stoich.:	A13B22 (1)
Weight, g/mol:	178.172151
ΔH_f, kcal/mol:	-19.82
Dipole, Da:	0.64
IP(EA), eV:	-8.66(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-ditert-butylcyclopenta-1,3-diene

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=CC1)C(C)(C)C

DOS

IR

Vibrations