Geometry & MOs

Info

ID:	359773
PubChem CID:	127299817
Reduced:	SN3O3C21H25 (1)
Stoich.:	AB3C3D21E25 (1)
Weight, g/mol:	371.130363
ΔH_f, kcal/mol:	-93.52
Dipole, Da:	8.51
IP(EA), eV:	-8.7(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[2-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-yl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCCC1C(=O)NC2CCCC3=C2SC(=N3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations