Geometry & MOs

Info

ID:	74336
PubChem CID:	48421738
Reduced:	N3O4C15H19 (1)
Stoich.:	A3B4C15D19 (1)
Weight, g/mol:	226.131742
ΔH_f, kcal/mol:	-150.96
Dipole, Da:	3.0
IP(EA), eV:	-9.75(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(cyclopropylmethoxy)propanoyl]piperazin-2-one

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCNC(=O)C2

DOS

IR

Vibrations