Geometry & MOs

Info

ID:	138762
PubChem CID:	52422535
Reduced:	O2S2N5C13H17 (1)
Stoich.:	A2B2C5D13E17 (1)
Weight, g/mol:	316.164774
ΔH_f, kcal/mol:	38.4
Dipole, Da:	5.14
IP(EA), eV:	-8.37(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[2-(6-methyl-4-propan-2-ylpyrazolo[4,3-c]pyrazol-1-yl)ethyl]-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C2=C1N(N=C2)CCCNS(=O)(=O)C3=CC=CS3)C

DOS

IR

Vibrations