Geometry & MOs

Info

ID:	197676
PubChem CID:	78987112
Reduced:	N6C13H16 (1)
Stoich.:	A6B13C16 (1)
Weight, g/mol:	265.131408
ΔH_f, kcal/mol:	105.29
Dipole, Da:	5.49
IP(EA), eV:	-9.06(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(2-methylfuran-3-carbonyl)piperidine-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(N=NC(=C1C#N)N2CCN(CC2)CC#N)C

DOS

IR

Vibrations