Geometry & MOs

Info

ID:	224330
PubChem CID:	85341710
Reduced:	O2N5H15C18 (1)
Stoich.:	A2B5C15D18 (1)
Weight, g/mol:	333.194008
ΔH_f, kcal/mol:	167.67
Dipole, Da:	3.27
IP(EA), eV:	-9.22(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-tert-butyl 2-O-ethyl 4-benzylpyrrolidine-1,2-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=CCN=CC=CC2=CC=CC=C2[N+](=O)[O-])N=[N+]=[N-]

DOS

IR

Vibrations