Geometry & MOs

Info

ID:	367789
PubChem CID:	127325825
Reduced:	OSN3C19H21 (1)
Stoich.:	ABC3D19E21 (1)
Weight, g/mol:	360.198383
ΔH_f, kcal/mol:	13.09
Dipole, Da:	5.29
IP(EA), eV:	-8.37(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclobutyl]acetamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2(CCC2)NC(=O)C3=CC4=C(C=C3)NC(=C4C)C

DOS

IR

Vibrations