Geometry & MOs

Info

ID:	143024
PubChem CID:	53134373
Reduced:	SO2N3C20H23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	547.225326
ΔH_f, kcal/mol:	-16.41
Dipole, Da:	2.39
IP(EA), eV:	-8.88(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(cyclopentylsulfamoyl)-4-methoxyphenyl]-N-(2,4-dimethylphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=C(SC(=N1)N2C=CC=C2)C(=O)NC(C)C3=CC=C(C=C3)OC

DOS

IR

Vibrations