Geometry & MOs

Info

ID:	198908
PubChem CID:	79170902
Reduced:	OSN3C14H21 (1)
Stoich.:	ABC3D14E21 (1)
Weight, g/mol:	294.187818
ΔH_f, kcal/mol:	32.84
Dipole, Da:	7.61
IP(EA), eV:	-8.53(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[4-methyl-2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3-thiazol-5-yl]ethanamine

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)N2CCC3CCC(C2)N3C)C(=O)C

DOS

IR

Vibrations