Geometry & MOs

Info

ID:	304122
PubChem CID:	124495931
Reduced:	N3O3C19H29 (1)
Stoich.:	A3B3C19D29 (1)
Weight, g/mol:	423.252192
ΔH_f, kcal/mol:	-140.11
Dipole, Da:	4.48
IP(EA), eV:	-9.35(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[(2S)-1-benzoylpiperidin-2-yl]pyridin-2-yl]-N-propan-2-ylcarbamate

Drug info:

PubChemData

Smile

CC(C)N(C1=C(C=CC=N1)[C@@H]2CCCCN2C=O)C(=O)OC(C)(C)C

DOS

IR

Vibrations