Geometry & MOs

Info

ID:	449750
PubChem CID:	135301140
Reduced:	FO3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	234.093918
ΔH_f, kcal/mol:	-186.25
Dipole, Da:	3.44
IP(EA), eV:	-9.61(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC(C)CC(CF)(C(O)OCC1=CC=CC=C1)O

DOS

IR

Vibrations