Geometry & MOs

Info

ID:	150789
PubChem CID:	53790485
Reduced:	NO3C15H16 (2)
Stoich.:	AB3C15D16 (2)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-113.9
Dipole, Da:	1.45
IP(EA), eV:	-8.94(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2R)-2-benzyl-4-methyl-3-oxopiperazine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)CCCCC(=NOCC1=CC=C(C=C1)OCC2=C(OC(=N2)C3=CC=CO3)C)C4=CC=CC=C4

DOS

IR

Vibrations