Geometry & MOs

Info

ID:	375782
PubChem CID:	134221772
Reduced:	SN2O5C23H26 (1)
Stoich.:	AB2C5D23E26 (1)
Weight, g/mol:	462.124943
ΔH_f, kcal/mol:	-187.64
Dipole, Da:	5.05
IP(EA), eV:	-8.95(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2,4-dioxo-5-[[4-(2-pyridin-2-ylethoxy)phenyl]methyl]-1,3-thiazolidine-5-carboxylate

Drug info:

PubChemData

Smile

CCCC(=O)OC(C)C1=CN=C(C=C1)CCOC2=CC=C(C=C2)C[C@H]3C(=O)NC(=O)S3

DOS

IR

Vibrations