Geometry & MOs

Info

ID:	271472
PubChem CID:	103680446
Reduced:	OSN2C15H20 (1)
Stoich.:	ABC2D15E20 (1)
Weight, g/mol:	311.166748
ΔH_f, kcal/mol:	-1.22
Dipole, Da:	2.96
IP(EA), eV:	-9.07(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C)CNCCC2=CC=CC=C2OC

DOS

IR

Vibrations