Geometry & MOs

Info

ID:	150968
PubChem CID:	53790665
Reduced:	SN6O6C22H34 (1)
Stoich.:	AB6C6D22E34 (1)
Weight, g/mol:	166.172151
ΔH_f, kcal/mol:	-198.93
Dipole, Da:	4.38
IP(EA), eV:	-9.3(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dodeca-4,8-diene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)[C@@](CNC(=O)C[C@H]2C[C@H](NO2)CN3CCC(CC3)C(=N)N)(C(=O)O)N

DOS

IR

Vibrations