Geometry & MOs

Info

ID:	243648
PubChem CID:	99233627
Reduced:	N4O5C23H30 (1)
Stoich.:	A4B5C23D30 (1)
Weight, g/mol:	451.247107
ΔH_f, kcal/mol:	-217.01
Dipole, Da:	10.55
IP(EA), eV:	-9.29(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[(3S)-1-(3-benzamido-4-methylbenzoyl)piperidin-3-yl]methyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC[C@@H]1CCCN(C1)C(=O)CNC(=O)C2=CNC3=CC=CC=C3C2=O

DOS

IR

Vibrations