Geometry & MOs

Info

ID:	349685
PubChem CID:	127275837
Reduced:	SO2N6C18H26 (1)
Stoich.:	AB2C6D18E26 (1)
Weight, g/mol:	360.125612
ΔH_f, kcal/mol:	-36.06
Dipole, Da:	2.0
IP(EA), eV:	-8.86(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-3-(5-pyridin-4-yl-1,2-oxazole-3-carbonyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2=NNC(=C2)C(=O)N3CSCC3C(=O)NC(C)(C)C

DOS

IR

Vibrations