Geometry & MOs

Info

ID:	293794
PubChem CID:	117402031
Reduced:	O2N3C14H17 (1)
Stoich.:	A2B3C14D17 (1)
Weight, g/mol:	259.132077
ΔH_f, kcal/mol:	-34.33
Dipole, Da:	2.3
IP(EA), eV:	-9.01(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[1-(aminomethyl)cyclopropyl]phenyl]piperazine-2,5-dione

Drug info:

PubChemData

Smile

CN1C(=O)CN(CC1=O)C2=CC=C(C=C2)C3(CC3)N

DOS

IR

Vibrations