Geometry & MOs

Info

ID:	218252
PubChem CID:	85089091
Reduced:	O3C29H46 (1)
Stoich.:	A3B29C46 (1)
Weight, g/mol:	442.293463
ΔH_f, kcal/mol:	-193.3
Dipole, Da:	6.31
IP(EA), eV:	-9.8(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[tert-butyl(dimethyl)silyl]oxy-5,7-dimethyl-6-triethylsilyloxycyclohept-2-en-1-yl] acetate

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2C1(CCC3C2C(CC4=CC(=O)CCC34C)OC(=O)C)C

DOS

IR

Vibrations