Geometry & MOs

Info

ID:	354304
PubChem CID:	127286268
Reduced:	NOC6H9 (3)
Stoich.:	ABC6D9 (3)
Weight, g/mol:	374.177647
ΔH_f, kcal/mol:	-112.33
Dipole, Da:	4.84
IP(EA), eV:	-8.59(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(methoxymethyl)-1,3-benzothiazol-2-yl]-2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)NC(=O)N2CCCOCC2)N3CCOCC3

DOS

IR

Vibrations