Geometry & MOs

Info

ID:	148363
PubChem CID:	53788025
Reduced:	N2O2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	379.171834
ΔH_f, kcal/mol:	-64.29
Dipole, Da:	5.28
IP(EA), eV:	-9.62(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-2-methyl-6-[(8-phenyl-1,6-diazabicyclo[3.2.1]octan-2-yl)methyl]-1,3-benzothiazole

Drug info:

PubChemData

Smile

CCCC(CC1=CC=C(C=C1)C(=N)N)OC=O

DOS

IR

Vibrations