Geometry & MOs

Info

ID:	243678
PubChem CID:	99233836
Reduced:	N2O5C21H30 (1)
Stoich.:	A2B5C21D30 (1)
Weight, g/mol:	389.231456
ΔH_f, kcal/mol:	-222.86
Dipole, Da:	3.94
IP(EA), eV:	-8.75(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[(3R)-1-[2-[(4-methylbenzoyl)amino]acetyl]piperidin-3-yl]methyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC[C@@H]1CCCN(C1)C(=O)CCC2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations