Geometry & MOs

Info

ID:	304125
PubChem CID:	124496006
Reduced:	N3O3C20H31 (1)
Stoich.:	A3B3C20D31 (1)
Weight, g/mol:	437.267842
ΔH_f, kcal/mol:	-149.44
Dipole, Da:	7.1
IP(EA), eV:	-9.47(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[5-[(2S)-1-benzoylpiperidin-2-yl]pyridin-2-yl]-N-[(2R)-butan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCCCN(C1=C(C=CC=N1)[C@H]2CCCN2C(=O)C)C(=O)OC(C)(C)C

DOS

IR

Vibrations