Geometry & MOs

Info

ID:	290100
PubChem CID:	104408337
Reduced:	SN2O3C15H24 (1)
Stoich.:	AB2C3D15E24 (1)
Weight, g/mol:	253.124883
ΔH_f, kcal/mol:	-131.97
Dipole, Da:	8.33
IP(EA), eV:	-8.99(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-ethyl-1,3-thiazol-2-yl)amino]-1-pyrrolidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C(C)NC1=CC=CC=C1S(=O)(=O)CC

DOS

IR

Vibrations