Geometry & MOs

Info

ID:	425992
PubChem CID:	135134502
Reduced:	O2N4C25H28 (1)
Stoich.:	A2B4C25D28 (1)
Weight, g/mol:	443.232125
ΔH_f, kcal/mol:	5.76
Dipole, Da:	2.09
IP(EA), eV:	-8.48(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(1-methylpiperidin-4-yl)oxy-5-(2-phenyl-1,2,4-triazol-3-yl)spiro[1H-indole-3,1'-cyclopentane]-2-one

Drug info:

PubChemData

Smile

CN(C)CCOC1=CC(=CC2=C1NC(=O)C23CCCC3)C4=CC=NN4C5=CC=CC=C5

DOS

IR

Vibrations