Geometry & MOs

Info

ID:	5666
PubChem CID:	13457
Reduced:	NO3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	237.136493
ΔH_f, kcal/mol:	-117.1
Dipole, Da:	2.68
IP(EA), eV:	-9.1(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[7-(hydroxymethyl)-2,3,5,8-tetrahydro-1H-pyrrolizin-1-yl] 2-methylbut-2-enoate

Drug info:

PubChemData

Smile

CC=C(C)C(=O)OC1CCN2C1C(=CC2)CO

DOS

IR

Vibrations