Geometry & MOs

Info

ID:	356039
PubChem CID:	127291068
Reduced:	Cl2N3O3C17H21 (1)
Stoich.:	A2B3C3D17E21 (1)
Weight, g/mol:	355.225977
ΔH_f, kcal/mol:	-127.19
Dipole, Da:	0.71
IP(EA), eV:	-9.32(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(7-ethyl-1H-indol-3-yl)-N-(oxan-3-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(COC1)NC(=O)N2CCN(CC2)C(=O)C3=C(C=CC=C3Cl)Cl

DOS

IR

Vibrations