Geometry & MOs

Info

ID:	33050
PubChem CID:	7850471
Reduced:	SN3O4C20H23 (1)
Stoich.:	AB3C4D20E23 (1)
Weight, g/mol:	334.152872
ΔH_f, kcal/mol:	-117.26
Dipole, Da:	8.29
IP(EA), eV:	-9.04(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] (E)-3-(2-ethoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC(C)CNC(=O)COC(=O)/C=C/C1=CSC(=N1)N(C2=CC=CC=C2)C(=O)C

DOS

IR

Vibrations