Geometry & MOs

Info

ID:	386451
PubChem CID:	134981786
Reduced:	IPH20C21 (1)
Stoich.:	ABC20D21 (1)
Weight, g/mol:	263.224915
ΔH_f, kcal/mol:	69.56
Dipole, Da:	6.73
IP(EA), eV:	-7.84(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(Z)-non-2-enyl]-2,5,6,7,8,8a-hexahydro-1H-indolizin-3-one

Drug info:

PubChemData

Smile

C1CC1P(C2=CC=CC=C2)(C3=CC=CC=C3)(C4=CC=CC=C4)I

DOS

IR

Vibrations