Geometry & MOs

Info

ID:	184818
PubChem CID:	77212743
Reduced:	ClON2C10H13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	467.238434
ΔH_f, kcal/mol:	-11.82
Dipole, Da:	5.87
IP(EA), eV:	-9.38(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2,5-difluorophenyl)prop-2-enyl]-1-[(2-methoxy-8,8a-dihydro-7H-furo[2,3-b]quinolin-9-yl)methyl]piperidin-4-amine

Drug info:

PubChemData

Smile

C1CCC2=C(N=NC(=O)C2C1)CCCl

DOS

IR

Vibrations