Geometry & MOs

Info

ID:	138960
PubChem CID:	52448797
Reduced:	NO2C16H17 (1)
Stoich.:	AB2C16D17 (1)
Weight, g/mol:	282.125594
ΔH_f, kcal/mol:	-61.14
Dipole, Da:	3.52
IP(EA), eV:	-9.28(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-3-(2-methoxyphenyl)-2-phenylprop-2-enoate

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=C2CCCC2=NC3=CC=CC=C31

DOS

IR

Vibrations