Geometry & MOs

Info

ID:	155398
PubChem CID:	56354973
Reduced:	O4N5C23H31 (1)
Stoich.:	A4B5C23D31 (1)
Weight, g/mol:	442.294391
ΔH_f, kcal/mol:	-146.96
Dipole, Da:	5.39
IP(EA), eV:	-8.66(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-[[1-(2,2-dimethylpropanoyl)piperidine-4-carbonyl]amino]phenyl]ethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC(=O)NC2=CC=C(C=C2)CCN3CCC(CC3)C(=O)N)C4CC4

DOS

IR

Vibrations