Geometry & MOs

Info

ID:	229907
PubChem CID:	87569488
Reduced:	NO2S2H13C14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	142.062994
ΔH_f, kcal/mol:	-42.15
Dipole, Da:	9.19
IP(EA), eV:	-8.45(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-3-methoxyprop-2-enyl] prop-2-enoate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)N)SSC2=CC=C(C=C2)C(=O)O

DOS

IR

Vibrations