Geometry & MOs

Info

ID:	176337
PubChem CID:	76035120
Reduced:	F2O2N5H17C25 (1)
Stoich.:	A2B2C5D17E25 (1)
Weight, g/mol:	392.221226
ΔH_f, kcal/mol:	-22.54
Dipole, Da:	2.82
IP(EA), eV:	-9.01(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-indol-5-yloxy)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(C=N1)C2=CC3=C(C(=C2)F)OC4=C(C35COC(=N5)N)C=C(C=C4)C6=C(N=CC=C6)F

DOS

IR

Vibrations