Geometry & MOs

Info

ID:	409610
PubChem CID:	135082392
Reduced:	C14H19 (3)
Stoich.:	A14B19 (3)
Weight, g/mol:	188.156501
ΔH_f, kcal/mol:	119.12
Dipole, Da:	3.37
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 2.072886
Charge, e:	0

Chem-info

IUPAC name:

7,7,9,9-tetramethyltricyclo[6.1.1.02,6]deca-3,5-diene

Drug info:

PubChemData

Smile

CC1(C2CC1C(C3=C2C=C[CH-]3)(C)C)C.CC1(C2CC1C(C3=C2C=C[CH-]3)(C)C)C.CC1(C2CC1C(C3=C2C=C[CH-]3)(C)C)C

DOS

IR

Vibrations