Geometry & MOs

Info

ID:	353026
PubChem CID:	127284176
Reduced:	OSN5C20H29 (1)
Stoich.:	ABC5D20E29 (1)
Weight, g/mol:	390.080491
ΔH_f, kcal/mol:	-2.17
Dipole, Da:	5.92
IP(EA), eV:	-8.8(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chlorobenzoyl)-N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCN(CC1)C2=C3C=CSC3=NC=N2)N4CCCCC4

DOS

IR

Vibrations