Geometry & MOs

Info

ID:	357092
PubChem CID:	127293162
Reduced:	OF3N4C18H27 (1)
Stoich.:	AB3C4D18E27 (1)
Weight, g/mol:	345.162332
ΔH_f, kcal/mol:	-192.45
Dipole, Da:	3.93
IP(EA), eV:	-8.85(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)N1C(=C(C=N1)C(=O)NC2CCN(C2)C3CCCC3)C(F)(F)F

DOS

IR

Vibrations