Geometry & MOs

Info

ID:	386147
PubChem CID:	134980909
Reduced:	VO4H7C13 (1)
Stoich.:	AB4C7D13 (1)
Weight, g/mol:	164.156501
ΔH_f, kcal/mol:	23.1
Dipole, Da:	2.57
IP(EA), eV:	-7.27(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,8-dimethyl-6-methylidenenon-4-yne

Drug info:

PubChemData

Smile

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C2[CH]C=CC2=C1.[V]

DOS

IR

Vibrations