Geometry & MOs

Info

ID:	50459
PubChem CID:	12012997
Reduced:	NSeO2C21H29 (1)
Stoich.:	ABC2D21E29 (1)
Weight, g/mol:	407.13635
ΔH_f, kcal/mol:	-56.9
Dipole, Da:	8.08
IP(EA), eV:	-8.62(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6E)-N,N,6-trimethyl-3-oxo-2-phenylselanyldodeca-6,11-dienamide

Drug info:

PubChemData

Smile

CC(=C)CC/C=C(\C)/CCC(=O)C(C(=O)N(C)C)[Se]C1=CC=CC=C1

DOS

IR

Vibrations