Geometry & MOs

Info

ID:	411296
PubChem CID:	135084109
Reduced:	OC12H22 (1)
Stoich.:	AB12C22 (1)
Weight, g/mol:	194.167065
ΔH_f, kcal/mol:	-72.82
Dipole, Da:	3.1
IP(EA), eV:	-9.44(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCC(=C)CC(=O)C(C)(C)C

DOS

IR

Vibrations