Geometry & MOs

Info

ID:	360326
PubChem CID:	127300969
Reduced:	O2N4C23H32 (1)
Stoich.:	A2B4C23D32 (1)
Weight, g/mol:	368.196074
ΔH_f, kcal/mol:	-55.4
Dipole, Da:	7.84
IP(EA), eV:	-8.59(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-6-[2-oxo-2-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]ethyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2CCCN2C(=O)C(C3=CC=CC=C3)N4CCC(CC4)O

DOS

IR

Vibrations