Geometry & MOs

Info

ID:	244064
PubChem CID:	99309558
Reduced:	NO2C13H14 (2)
Stoich.:	AB2C13D14 (2)
Weight, g/mol:	384.241293
ΔH_f, kcal/mol:	-111.75
Dipole, Da:	4.91
IP(EA), eV:	-8.84(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-N-[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CC(=O)N2CCC(CC2)NC(=O)COC3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations