Geometry & MOs

Info

ID:	418386
PubChem CID:	135104488
Reduced:	ClN3O3C16H20 (1)
Stoich.:	AB3C3D16E20 (1)
Weight, g/mol:	351.194677
ΔH_f, kcal/mol:	-63.07
Dipole, Da:	6.07
IP(EA), eV:	-9.35(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydroindol-1-yl)-2-[oxolan-2-ylmethyl(pyridin-2-ylmethyl)amino]ethanone

Drug info:

PubChemData

Smile

CCCNC(=O)C1=C(ON=C1NCCOC)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations