Geometry & MOs

Info

ID:	324862
PubChem CID:	126678497
Reduced:	O4N5C18H21 (1)
Stoich.:	A4B5C18D21 (1)
Weight, g/mol:	202.062994
ΔH_f, kcal/mol:	-26.79
Dipole, Da:	3.77
IP(EA), eV:	-8.57(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-prop-2-enoylphenyl) prop-2-enoate

Drug info:

PubChemData

Smile

C1C(NN(N1)C2=CC=CC=C2)CN3C4C=C(C=CC4OCC3=O)C(=O)NO

DOS

IR

Vibrations