Geometry & MOs

Info

ID:	196047
PubChem CID:	78772231
Reduced:	O2S2N3C18H19 (1)
Stoich.:	A2B2C3D18E19 (1)
Weight, g/mol:	370.098728
ΔH_f, kcal/mol:	-21.22
Dipole, Da:	2.08
IP(EA), eV:	-8.86(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[3-(5-phenylfuran-2-yl)propanoylamino]-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=NC=N2)SCC(=O)OCCCC3=CC=NC=C3)C

DOS

IR

Vibrations