Geometry & MOs

Info

ID:	304104
PubChem CID:	124493567
Reduced:	SO2N3C16H19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	205.121512
ΔH_f, kcal/mol:	-40.5
Dipole, Da:	5.42
IP(EA), eV:	-8.64(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(2-aminopyridin-3-yl)piperidine-1-carbaldehyde

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H]2C3=C(N=CC=C3)N

DOS

IR

Vibrations