Geometry & MOs

Info

ID:	203357
PubChem CID:	79819619
Reduced:	NS2O3C12H19 (1)
Stoich.:	AB2C3D12E19 (1)
Weight, g/mol:	289.161269
ΔH_f, kcal/mol:	-134.36
Dipole, Da:	7.48
IP(EA), eV:	-9.62(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-tert-butyl-1,3-thiazol-2-yl)-N-methyl-3-pyridin-3-ylpropan-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CSC(=N1)CC2(CCS(=O)(=O)C2)O

DOS

IR

Vibrations