Geometry & MOs

Info

ID:	36916
PubChem CID:	8014708
Reduced:	ClSN4O5C16H19 (1)
Stoich.:	ABC4D5E16F19 (1)
Weight, g/mol:	393.135842
ΔH_f, kcal/mol:	-176.54
Dipole, Da:	4.58
IP(EA), eV:	-9.38(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (6R)-6-methyl-2-[[2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Drug info:

PubChemData

Smile

CN1CC(=O)N(C1=O)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations