Geometry & MOs

Info

ID:	172397
PubChem CID:	75503883
Reduced:	ClN2O3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	349.215413
ΔH_f, kcal/mol:	-132.11
Dipole, Da:	6.88
IP(EA), eV:	-9.04(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[[3-(3-methylphenyl)cyclobutyl]amino]piperidin-1-yl]-pyridin-4-ylmethanone

Drug info:

PubChemData

Smile

CC(C1CCN(C1)C(=O)NCC2=C(C=CC(=C2)Cl)OC)O

DOS

IR

Vibrations