Geometry & MOs

Info

ID:	47268
PubChem CID:	10531033
Reduced:	O2C18H35 (2)
Stoich.:	A2B18C35 (2)
Weight, g/mol:	566.179477
ΔH_f, kcal/mol:	-335.99
Dipole, Da:	2.35
IP(EA), eV:	-10.48(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (7S,9R)-3-(4-chlorophenyl)-1,7,9-triphenyl-8-thia-1,2-diazaspiro[4.5]dec-2-ene-4-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCC)COC(=O)CCCCCCC

DOS

IR

Vibrations