Geometry & MOs

Info

ID:	187142
PubChem CID:	77535315
Reduced:	F3N4O4C27H29 (1)
Stoich.:	A3B4C4D27E29 (1)
Weight, g/mol:	462.205213
ΔH_f, kcal/mol:	-254.97
Dipole, Da:	6.56
IP(EA), eV:	-8.89(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-(3-methoxypropoxy)-N-piperidin-3-yl-N-propan-2-yl-4-propan-2-yloxybenzamide;hydrochloride

Drug info:

PubChemData

Smile

CC1=NN(C(=C1C2=CC3=C(C=C2)OCC(=O)N3)C4=CC=C(C=C4)F)CC(CNC(CC(C)C)C(=O)O)(F)F

DOS

IR

Vibrations