Geometry & MOs

Info

ID:	353090
PubChem CID:	127284247
Reduced:	S2N4O5C13H16 (1)
Stoich.:	A2B4C5D13E16 (1)
Weight, g/mol:	286.117824
ΔH_f, kcal/mol:	-105.42
Dipole, Da:	3.38
IP(EA), eV:	-9.8(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,7-dimethyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations