Geometry & MOs

Info

ID:	382047
PubChem CID:	134972955
Reduced:	O4C11H14 (1)
Stoich.:	A4B11C14 (1)
Weight, g/mol:	400.243372
ΔH_f, kcal/mol:	-157.2
Dipole, Da:	3.28
IP(EA), eV:	-9.88(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl-[(3S,5R)-5-[(4-methoxyphenyl)methoxy]deca-1,6-diyn-3-yl]oxy-dimethylsilane

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H]2[C@H]([C@H]([C@H](O2)CO)O)O

DOS

IR

Vibrations