Geometry & MOs

Info

ID:	361291
PubChem CID:	127302486
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	388.193297
ΔH_f, kcal/mol:	-92.11
Dipole, Da:	2.53
IP(EA), eV:	-9.02(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,6-dimethylmorpholin-4-yl)methyl]-N-(2-methyl-1,3-benzothiazol-6-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)N2C3CCC2CC(C3)O

DOS

IR

Vibrations