Geometry & MOs

Info

ID:	165759
PubChem CID:	74593724
Reduced:	NOH10C11 (2)
Stoich.:	ABC10D11 (2)
Weight, g/mol:	356.125988
ΔH_f, kcal/mol:	13.0
Dipole, Da:	2.15
IP(EA), eV:	-9.08(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(2,4-dimethoxyphenyl)prop-2-enoyloxy]ethyl benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC2=CC=CC(=C2)C=CC(=O)NCCC3=CC=CC=N3

DOS

IR

Vibrations