Geometry & MOs

Info

ID:	402745
PubChem CID:	135057113
Reduced:	BO2C13H21 (1)
Stoich.:	AB2C13D21 (1)
Weight, g/mol:	190.135765
ΔH_f, kcal/mol:	-91.97
Dipole, Da:	4.93
IP(EA), eV:	-9.25(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-1-[(2-methylpropan-2-yl)oxy]prop-2-enyl]benzene

Drug info:

PubChemData

Smile

B(/C=C/CCC(=O)O)(C=C(C)C)C=C(C)C

DOS

IR

Vibrations