Geometry & MOs

Info

ID:	355569
PubChem CID:	127289327
Reduced:	OSN8C16H24 (1)
Stoich.:	ABC8D16E24 (1)
Weight, g/mol:	390.129652
ΔH_f, kcal/mol:	82.58
Dipole, Da:	5.73
IP(EA), eV:	-9.06(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(dimethylamino)thieno[2,3-d][1,3]thiazol-5-yl]-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)CC2=NC=CN2C)SC3=NN=NN3C4CC4

DOS

IR

Vibrations