Geometry & MOs

Info

ID:	32071
PubChem CID:	4265954
Reduced:	N3H23C24 (1)
Stoich.:	A3B23C24 (1)
Weight, g/mol:	268.097855
ΔH_f, kcal/mol:	96.81
Dipole, Da:	4.0
IP(EA), eV:	-8.53(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-chloro-2-hydroxyphenyl)methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CNC2=NC=C(N2C)C3=CC=C(C=C3)C4=CC=CC=C4

DOS

IR

Vibrations