Geometry & MOs

Info

ID:	351561
PubChem CID:	127280453
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	370.211724
ΔH_f, kcal/mol:	-139.45
Dipole, Da:	3.28
IP(EA), eV:	-8.79(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carbonyl)piperazin-1-yl]-2-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

CC1C(OC2=CC=CC=C2O1)C(=O)N3CCN(CC3)C(=O)CN4CCCC4

DOS

IR

Vibrations