Geometry & MOs

Info

ID:	170929
PubChem CID:	75303625
Reduced:	O5C26H36 (1)
Stoich.:	A5B26C36 (1)
Weight, g/mol:	542.342751
ΔH_f, kcal/mol:	-178.74
Dipole, Da:	2.2
IP(EA), eV:	-10.07(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[7-[tert-butyl(dimethyl)silyl]oxy-5,15-dihydroxy-10,14-dimethyl-15-hexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadecanyl]prop-2-ynoate

Drug info:

PubChemData

Smile

CCOC(=O)C#CC1(C2CC2C3C1(CCC4C3C5CC5C6(C4(CCC(C6)O)C)O)C)O

DOS

IR

Vibrations