Geometry & MOs

Info

ID:	354285
PubChem CID:	127286249
Reduced:	O2N5C20H27 (1)
Stoich.:	A2B5C20D27 (1)
Weight, g/mol:	374.177647
ΔH_f, kcal/mol:	-17.25
Dipole, Da:	6.76
IP(EA), eV:	-9.0(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methoxy-2-methyl-1,3-benzothiazol-6-yl)-2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=N1)C2=CC=C(C=C2)NC(=O)N3CCN4CCCCC4C3

DOS

IR

Vibrations