Geometry & MOs

Info

ID:	383615
PubChem CID:	134975427
Reduced:	LiN2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	317.96182
ΔH_f, kcal/mol:	54.28
Dipole, Da:	10.05
IP(EA), eV:	-7.02(1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-methyl-3-(2-oxopropyl)-1-oxa-2lambda4-selenacyclopenta-2,4-dien-2-yl] 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

[Li+].CN(C)CN1[C-]=CC2=CC=CC=C21

DOS

IR

Vibrations