Geometry & MOs

Info

ID:	121987
PubChem CID:	50789052
Reduced:	O3N4C21H32 (1)
Stoich.:	A3B4C21D32 (1)
Weight, g/mol:	411.215806
ΔH_f, kcal/mol:	-119.23
Dipole, Da:	5.74
IP(EA), eV:	-8.87(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[(2,4-dimethoxyphenyl)methylcarbamoyl]phenyl]-N-methylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)N1CCCC(C1)C2=CC(=CC=C2)C(=O)NCCCN3CCOCC3

DOS

IR

Vibrations