Geometry & MOs

Info

ID:	401177
PubChem CID:	135050437
Reduced:	AlNC11H24 (1)
Stoich.:	ABC11D24 (1)
Weight, g/mol:	184.182715
ΔH_f, kcal/mol:	-43.7
Dipole, Da:	3.57
IP(EA), eV:	-9.33(1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-3-butyl-2-methyl-2-pentyloxirane

Drug info:

PubChemData

Smile

CC[Al](CC)CC.CC(C)(C)C#N

DOS

IR

Vibrations