Geometry & MOs

Info

ID:	349801
PubChem CID:	127276193
Reduced:	O3N6C13H20 (1)
Stoich.:	A3B6C13D20 (1)
Weight, g/mol:	281.210327
ΔH_f, kcal/mol:	-52.42
Dipole, Da:	6.56
IP(EA), eV:	-9.77(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-ethylpyrrolidine-1-carbonyl)-N,N-dimethylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(COC1)C(=O)N2CCN(CC2)C(=O)CN3C=NN=N3

DOS

IR

Vibrations