Geometry & MOs

Info

ID:	129126
PubChem CID:	51071091
Reduced:	N3O3C27H41 (1)
Stoich.:	A3B3C27D41 (1)
Weight, g/mol:	483.346092
ΔH_f, kcal/mol:	-177.69
Dipole, Da:	5.89
IP(EA), eV:	-9.34(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2R)-2-[(2-methylbenzoyl)amino]cyclohexyl]-1-nonanoylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCCCCCC(=O)N1CCC(CC1)C(=O)N[C@@H]2CCCC[C@H]2NC(=O)C3=CC=CC=C3C

DOS

IR

Vibrations