Geometry & MOs

Info

ID:	179298
PubChem CID:	76462870
Reduced:	NSeO3C14H17 (1)
Stoich.:	ABC3D14E17 (1)
Weight, g/mol:	440.204633
ΔH_f, kcal/mol:	-92.07
Dipole, Da:	3.71
IP(EA), eV:	-9.14(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[8-ethenyl-10-(2-methoxy-2-oxoethylidene)-3,3-dimethyl-4-oxo-1,7-dioxaspiro[5.5]undecan-2-yl]-3,5-dihydroxyhexanoic acid

Drug info:

PubChemData

Smile

C1C2C(CC3C1OCO3)NC(CC2=O)C4=CC=C[Se]4

DOS

IR

Vibrations