Geometry & MOs

Info

ID:	353359
PubChem CID:	127284688
Reduced:	OSN5C16H23 (1)
Stoich.:	ABC5D16E23 (1)
Weight, g/mol:	344.130697
ΔH_f, kcal/mol:	5.6
Dipole, Da:	3.42
IP(EA), eV:	-8.86(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyclopropyl-1,3-thiazol-4-yl)-[4-(4-methoxypyridin-2-yl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNC(=O)C2CCN(CC2)CC3=NC=CN3C

DOS

IR

Vibrations