Geometry & MOs

Info

ID:	364633
PubChem CID:	127315928
Reduced:	O2N5C19H25 (1)
Stoich.:	A2B5C19D25 (1)
Weight, g/mol:	347.159354
ΔH_f, kcal/mol:	-24.95
Dipole, Da:	1.95
IP(EA), eV:	-8.93(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(1,3-dimethylpyrazole-4-carbonyl)piperazin-1-yl]-2-oxoethyl]pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CC1=NN(C=C1C(=O)N2CCN(CC2)C(=O)N(C)CC3=CC=CC=C3)C

DOS

IR

Vibrations