Geometry & MOs

Info

ID:	191515
PubChem CID:	78156013
Reduced:	O2C7H9 (2)
Stoich.:	A2B7C9 (2)
Weight, g/mol:	255.183444
ΔH_f, kcal/mol:	-138.41
Dipole, Da:	2.03
IP(EA), eV:	-8.18(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[2-(hydroxymethyl)prop-2-enyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)CC=CC1=CC(=C(C=C1)OC)OC

DOS

IR

Vibrations