Geometry & MOs

Info

ID:	148531
PubChem CID:	53788196
Reduced:	BrSN2C5H7 (1)
Stoich.:	ABC2D5E7 (1)
Weight, g/mol:	382.135114
ΔH_f, kcal/mol:	24.42
Dipole, Da:	2.74
IP(EA), eV:	-9.08(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,5-dimethylphenyl)methyl]-3-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]-5-methylbenzamide

Drug info:

PubChemData

Smile

C1=C(SC(=N1)N)CCBr

DOS

IR

Vibrations