Geometry & MOs

Info

ID:	363997
PubChem CID:	127313666
Reduced:	SO2N4C15H18 (1)
Stoich.:	AB2C4D15E18 (1)
Weight, g/mol:	384.173231
ΔH_f, kcal/mol:	-35.31
Dipole, Da:	3.98
IP(EA), eV:	-9.51(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2(CCCC2)NC(=O)CN3C=CC=NC3=O

DOS

IR

Vibrations