Geometry & MOs

Info

ID:	380026
PubChem CID:	134964500
Reduced:	OC11H22 (1)
Stoich.:	AB11C22 (1)
Weight, g/mol:	258.125594
ΔH_f, kcal/mol:	-92.21
Dipole, Da:	3.06
IP(EA), eV:	-9.9(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-1,3-bis[(1R)-1-methoxyprop-2-ynyl]-5-methylbenzene

Drug info:

PubChemData

Smile

CCCC[C@@](C)(CC)CC(=O)C

DOS

IR

Vibrations