Geometry & MOs

Info

ID:	449882
PubChem CID:	135302255
Reduced:	OH3C9 (2)
Stoich.:	AB3C9 (2)
Weight, g/mol:	531.068794
ΔH_f, kcal/mol:	322.08
Dipole, Da:	5.59
IP(EA), eV:	-9.17(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[(2E,4E)-4,6-dichlorohepta-2,4,6-trienoyl]morpholin-3-yl]methyl]-5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyridine-2-carboxamide

Drug info:

PubChemData

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CC(=C)C(=O)OC#CC#CC#CC#CC#CC#CC#C

DOS

IR

Vibrations