Geometry & MOs

Info

ID:	51783
PubChem CID:	12014523
Reduced:	O3C16H18 (1)
Stoich.:	A3B16C18 (1)
Weight, g/mol:	266.094294
ΔH_f, kcal/mol:	-94.99
Dipole, Da:	2.19
IP(EA), eV:	-10.03(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-benzoylprop-2-enoate

Drug info:

PubChemData

Smile

C=C(C(=O)C1=CC=CC=C1)C(=O)OC2CCCCC2

DOS

IR

Vibrations