Geometry & MOs

Info

ID:	182760
PubChem CID:	76936046
Reduced:	O2N6C9H16 (1)
Stoich.:	A2B6C9D16 (1)
Weight, g/mol:	322.029125
ΔH_f, kcal/mol:	-11.16
Dipole, Da:	5.83
IP(EA), eV:	-9.58(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-(4-chloro-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CCC(C(=NO)N)C(=O)NCC1=NN=CN1C

DOS

IR

Vibrations