Geometry & MOs

Info

ID:	366791
PubChem CID:	127320328
Reduced:	O2S2N3C13H21 (1)
Stoich.:	A2B2C3D13E21 (1)
Weight, g/mol:	331.102434
ΔH_f, kcal/mol:	-42.83
Dipole, Da:	4.58
IP(EA), eV:	-8.78(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[[4-(oxolan-3-ylsulfonyl)piperazin-1-yl]methyl]-1,3-thiazole

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CN2CCN(CC2)S(=O)(=O)CC3CC3

DOS

IR

Vibrations