Geometry & MOs

Info

ID:	196634
PubChem CID:	78856928
Reduced:	O2N3C21H23 (1)
Stoich.:	A2B3C21D23 (1)
Weight, g/mol:	365.111789
ΔH_f, kcal/mol:	-21.28
Dipole, Da:	4.32
IP(EA), eV:	-9.01(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(1-hydroxypropan-2-yl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC(C)CO)C3=CC=CC=C3)C

DOS

IR

Vibrations