Geometry & MOs

Info

ID:	290373
PubChem CID:	104436166
Reduced:	SN3O3C12H17 (1)
Stoich.:	AB3C3D12E17 (1)
Weight, g/mol:	181.092521
ΔH_f, kcal/mol:	-110.27
Dipole, Da:	10.27
IP(EA), eV:	-8.97(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethyl)-4-propyl-1,3-thiazole

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)CCNC2=NC(=CS2)CC(=O)O

DOS

IR

Vibrations