Geometry & MOs

Info

ID:	123634
PubChem CID:	50857254
Reduced:	N3O3C18H23 (1)
Stoich.:	A3B3C18D23 (1)
Weight, g/mol:	370.098728
ΔH_f, kcal/mol:	-55.69
Dipole, Da:	3.62
IP(EA), eV:	-8.2(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(5Z)-5-[(5-methyl-1-phenylpyrrol-3-yl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Drug info:

PubChemData

Smile

CC1=CC(=CN1C(C)C)/C=N/NC(=O)COC2=CC=C(C=C2)OC

DOS

IR

Vibrations