Geometry & MOs

Info

ID:	222230
PubChem CID:	85295388
Reduced:	O4C13H22 (1)
Stoich.:	A4B13C22 (1)
Weight, g/mol:	242.170207
ΔH_f, kcal/mol:	-203.94
Dipole, Da:	1.98
IP(EA), eV:	-9.97(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[tert-butyl(dimethyl)silyl] 3-methylhex-4-enoate

Drug info:

PubChemData

Smile

CC1(OC2C(C(C(=CC(C)(C)C)C2O1)O)O)C

DOS

IR

Vibrations