Geometry & MOs

Info

ID:	80762
PubChem CID:	49836659
Reduced:	IO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	274.187729
ΔH_f, kcal/mol:	-110.4
Dipole, Da:	1.99
IP(EA), eV:	-9.51(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-2-(4-methoxyphenyl)ethenyl]-bis(2-methylpropyl)alumane

Drug info:

PubChemData

Smile

CC1=CC[C@@H]2[C@@]([C@H]1C(=O)OC)(CC[C@@H](C2(C)C)I)C

DOS

IR

Vibrations