Geometry & MOs

Info

ID:	333487
PubChem CID:	127252039
Reduced:	O2N5C22H23 (1)
Stoich.:	A2B5C22D23 (1)
Weight, g/mol:	415.189592
ΔH_f, kcal/mol:	-0.67
Dipole, Da:	4.21
IP(EA), eV:	-8.75(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-[1-[2-(4-hydroxyphenyl)acetyl]piperidin-2-yl]pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CN=C(C=C2)C3=CN=C(N=C3)N)C(=O)CC4=CC=C(C=C4)O

DOS

IR

Vibrations