Geometry & MOs

Info

ID:	150975
PubChem CID:	53790672
Reduced:	O2N3C25H33 (1)
Stoich.:	A2B3C25D33 (1)
Weight, g/mol:	397.225308
ΔH_f, kcal/mol:	-66.2
Dipole, Da:	3.25
IP(EA), eV:	-8.9(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[2-(hydroxymethyl)-5-oxo-1-propan-2-ylpyrrolidin-3-yl]naphthalen-1-yl] hexanoate

Drug info:

PubChemData

Smile

CC(C)CN(CC(C)C)CN1C(=O)C(NC1=O)(CC2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations