Geometry & MOs

Info

ID:	187548
PubChem CID:	77589888
Reduced:	SN6O6C33H44 (1)
Stoich.:	AB6C6D33E44 (1)
Weight, g/mol:	312.160456
ΔH_f, kcal/mol:	-196.92
Dipole, Da:	10.66
IP(EA), eV:	-8.76(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-hydroxy-3-phenyl-1-piperidin-2-ylpropan-2-yl)acetamide;hydrochloride

Drug info:

PubChemData

Smile

CCC(C)NC1=CC(=CC(=N1)NCS(=O)(=O)C)C(=O)NC(CC2=CC=CC=C2)C(C3C(=O)N(CCN3)CC4=CC=C(C=C4)OC)O

DOS

IR

Vibrations