Geometry & MOs

Info

ID:	45589
PubChem CID:	10515277
Reduced:	BrO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	257.105193
ΔH_f, kcal/mol:	-40.93
Dipole, Da:	0.92
IP(EA), eV:	-9.3(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenylethyl pyridin-3-ylmethyl carbonate

Drug info:

PubChemData

Smile

C/C(=C\C(=O)OC)/C=C/C=C/C=C/Br

DOS

IR

Vibrations