Geometry & MOs

Info

ID:	75777
PubChem CID:	48423968
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-17.45
Dipole, Da:	3.32
IP(EA), eV:	-8.97(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[3-[2-(cyclopropylmethoxy)propanoylamino]phenyl]methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=NC=C(C=C2)CNC(=O)C(C)OCC3CC3)C

DOS

IR

Vibrations