Geometry & MOs

Info

ID:	24218
PubChem CID:	608468
Reduced:	NS2O3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	313.080636
ΔH_f, kcal/mol:	-109.17
Dipole, Da:	3.68
IP(EA), eV:	-9.15(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butyl-7a-[hydroxy(thiophen-2-yl)methyl]-5,7-dihydro-3H-[1,3]thiazolo[3,4-c][1,3]oxazol-1-one

Drug info:

PubChemData

Smile

CC(C)(C)C1N2CSCC2(C(=O)O1)C(C3=CC=CS3)O

DOS

IR

Vibrations