Geometry & MOs

Info

ID:	386179
PubChem CID:	134980995
Reduced:	TcO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	357.956224
ΔH_f, kcal/mol:	-32.38
Dipole, Da:	4.39
IP(EA), eV:	-8.05(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC1=C(C(=C([C]1C)C)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Tc]

DOS

IR

Vibrations