Geometry & MOs

Info

ID:	64909
PubChem CID:	29204180
Reduced:	SO2N3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	319.189592
ΔH_f, kcal/mol:	-56.47
Dipole, Da:	5.42
IP(EA), eV:	-8.9(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-(pyridin-2-ylmethylcarbamoyl)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CSC(=O)N1CCCC(=O)NCC2=CC=CC=N2

DOS

IR

Vibrations