Geometry & MOs

Info

ID:	32350
PubChem CID:	6436667
Reduced:	PC3O3H7 (1)
Stoich.:	AB3C3D7 (1)
Weight, g/mol:	542.324354
ΔH_f, kcal/mol:	-176.9
Dipole, Da:	4.62
IP(EA), eV:	-10.82(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,4S,6R,8R,10E,14E,16E,20R,21R,24S)-6'-ethyl-21,24-dihydroxy-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one

Drug info:

PubChemData

Smile

C/C=C\P(=O)(O)O

DOS

IR

Vibrations