Geometry & MOs

Info

ID:	378261
PubChem CID:	134224337
Reduced:	NC13H25 (1)
Stoich.:	AB13C25 (1)
Weight, g/mol:	411.08453
ΔH_f, kcal/mol:	-25.32
Dipole, Da:	1.65
IP(EA), eV:	-8.68(1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-2-[(2E,4E)-5-fluorohexa-2,4-dien-2-yl]-6-methoxy-N,4,9-trimethyloxonine-3-carboxamide

Drug info:

PubChemData

Smile

CCC/C(=C\CC)/CC(CC)C(=C)N

DOS

IR

Vibrations