Geometry & MOs

Info

ID:	39620
PubChem CID:	8141673
Reduced:	ClS2N3O3H14C17 (1)
Stoich.:	AB2C3D3E14F17 (1)
Weight, g/mol:	366.985211
ΔH_f, kcal/mol:	-30.01
Dipole, Da:	5.69
IP(EA), eV:	-8.77(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OCC(=O)NCC(=O)NC2=NC(=CS2)C3=CC=C(S3)Cl

DOS

IR

Vibrations