Geometry & MOs

Info

ID:	304119
PubChem CID:	124495616
Reduced:	N3O4C24H31 (1)
Stoich.:	A3B4C24D31 (1)
Weight, g/mol:	333.241627
ΔH_f, kcal/mol:	-154.43
Dipole, Da:	4.17
IP(EA), eV:	-8.99(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[(2S)-1-methylpiperidin-2-yl]pyridin-2-yl]-N-propylcarbamate

Drug info:

PubChemData

Smile

CCN(C1=NC=C(C=C1)[C@H]2CCCN2C(=O)OCC3=CC=CC=C3)C(=O)OC(C)(C)C

DOS

IR

Vibrations