Geometry & MOs

Info

ID:	342103
PubChem CID:	127264816
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	253.167794
ΔH_f, kcal/mol:	-69.29
Dipole, Da:	7.8
IP(EA), eV:	-9.69(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-[1-(2-methylbut-2-enoyl)piperidin-3-yl]propanoic acid

Drug info:

PubChemData

Smile

CC(CN(C1CC1)C(=O)C=CC2=CC=CC=N2)C(=O)O

DOS

IR

Vibrations