Geometry & MOs

Info

ID:	408345
PubChem CID:	135081111
Reduced:	NSeO2C7H11 (1)
Stoich.:	ABC2D7E11 (1)
Weight, g/mol:	208.089958
ΔH_f, kcal/mol:	-65.09
Dipole, Da:	6.47
IP(EA), eV:	-8.51(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-5-(4-fluorophenyl)-3-(hydroxymethyl)pent-4-enal

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)OC)N=C=[Se]

DOS

IR

Vibrations