Geometry & MOs

Info

ID:	151761
PubChem CID:	56310527
Reduced:	FON4C22H25 (1)
Stoich.:	ABC4D22E25 (1)
Weight, g/mol:	362.199428
ΔH_f, kcal/mol:	-11.7
Dipole, Da:	8.77
IP(EA), eV:	-8.75(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1H-indol-3-yl)-2-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CN(CCN(C1)CC2=CC=CC=C2F)CCC(=O)NC3=CC=C(C=C3)C#N

DOS

IR

Vibrations