Geometry & MOs

Info

ID:	184027
PubChem CID:	77102323
Reduced:	N2O3C13H24 (1)
Stoich.:	A2B3C13D24 (1)
Weight, g/mol:	269.199094
ΔH_f, kcal/mol:	-138.26
Dipole, Da:	3.75
IP(EA), eV:	-8.94(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-ethyl-4-(3-propoxypiperidin-1-yl)but-2-enoate

Drug info:

PubChemData

Smile

CCCN(CC=C(CC)C(=O)O)CC(=O)N(C)C

DOS

IR

Vibrations