Geometry & MOs

Info

ID:	130237
PubChem CID:	51075349
Reduced:	NO4C12H17 (1)
Stoich.:	AB4C12D17 (1)
Weight, g/mol:	237.136493
ΔH_f, kcal/mol:	-153.31
Dipole, Da:	1.79
IP(EA), eV:	-9.21(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2-methylpiperidin-1-yl)methyl]furan-3-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C(OC=C1)CN2CCC(CC2)O

DOS

IR

Vibrations