Geometry & MOs

Info

ID:	380950
PubChem CID:	134971558
Reduced:	SiO6C31H62 (1)
Stoich.:	AB6C31D62 (1)
Weight, g/mol:	112.088815
ΔH_f, kcal/mol:	-413.72
Dipole, Da:	4.22
IP(EA), eV:	-8.7(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3,4-dimethylpent-4-enal

Drug info:

PubChemData

Smile

C[C@H](C[C@@H]1COC(O1)(C)C)[C@@H]([C@H]([C@H](C[C@@H](C[C@@H](C)C(=C)C)O[Si](C(C)C)(C(C)C)C(C)C)O)O)OC(C)C

DOS

IR

Vibrations