Geometry & MOs

Info

ID:	146764
PubChem CID:	53746061
Reduced:	N5C11H11 (1)
Stoich.:	A5B11C11 (1)
Weight, g/mol:	234.234751
ΔH_f, kcal/mol:	89.93
Dipole, Da:	3.33
IP(EA), eV:	-8.53(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-but-3-enyl-6-ethylundeca-1,5-diene

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=NC=CN=C2C(=N)N)N

DOS

IR

Vibrations