Geometry & MOs

Info

ID:	348496
PubChem CID:	127273607
Reduced:	SO3N6C13H18 (1)
Stoich.:	AB3C6D13E18 (1)
Weight, g/mol:	352.13176
ΔH_f, kcal/mol:	-43.75
Dipole, Da:	11.87
IP(EA), eV:	-8.72(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)-3-oxopropyl]-1,2-dimethylimidazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NCC(=O)N2CCCN3C2=CC=N3

DOS

IR

Vibrations