Geometry & MOs

Info

ID:	351626
PubChem CID:	127280518
Reduced:	O3N5C20H25 (1)
Stoich.:	A3B5C20D25 (1)
Weight, g/mol:	366.226705
ΔH_f, kcal/mol:	-86.99
Dipole, Da:	5.48
IP(EA), eV:	-9.27(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-morpholin-4-yl-4-[4-(2-pyrrolidin-1-ylacetyl)piperazin-1-yl]butane-1,4-dione

Drug info:

PubChemData

Smile

C1CCN(C1)CC(=O)N2CCN(CC2)C(=O)CN3C=NC4=CC=CC=C4C3=O

DOS

IR

Vibrations