Geometry & MOs

Info

ID:	406792
PubChem CID:	135078623
Reduced:	NOC12H19 (1)
Stoich.:	ABC12D19 (1)
Weight, g/mol:	126.062528
ΔH_f, kcal/mol:	-48.85
Dipole, Da:	4.41
IP(EA), eV:	-9.32(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxyprop-1-ynyl(dimethyl)alumane

Drug info:

PubChemData

Smile

C[C@@H]1CCC(=C(C)C)C(C1)(CC#N)O

DOS

IR

Vibrations