Geometry & MOs

Info

ID:	203067
PubChem CID:	79773895
Reduced:	OSN3C12H19 (1)
Stoich.:	ABC3D12E19 (1)
Weight, g/mol:	256.054945
ΔH_f, kcal/mol:	-35.54
Dipole, Da:	5.13
IP(EA), eV:	-8.87(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-chloro-5-methylpyrazol-1-yl)methyl]-N-ethyl-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CCC1CCC(=O)N(CC1)CC2=CN=C(S2)N

DOS

IR

Vibrations