Geometry & MOs

Info

ID:	179727
PubChem CID:	76522316
Reduced:	NO4C17H21 (1)
Stoich.:	AB4C17D21 (1)
Weight, g/mol:	282.091238
ΔH_f, kcal/mol:	-142.66
Dipole, Da:	8.15
IP(EA), eV:	-9.7(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

N-tert-butyl-N-[2-oxo-1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)N(C(CC1=CC=CC=C1)C2C=CC(=O)O2)C(=O)O

DOS

IR

Vibrations