Geometry & MOs

Info

ID:	355029
PubChem CID:	127287890
Reduced:	SO2N3C16H17 (1)
Stoich.:	AB2C3D16E17 (1)
Weight, g/mol:	310.109962
ΔH_f, kcal/mol:	-40.68
Dipole, Da:	1.86
IP(EA), eV:	-8.7(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)[C@H]3CCC(=O)N3)C

DOS

IR

Vibrations