Geometry & MOs

Info

ID:	134826
PubChem CID:	51765136
Reduced:	N2O5C22H36 (1)
Stoich.:	A2B5C22D36 (1)
Weight, g/mol:	401.304228
ΔH_f, kcal/mol:	-225.8
Dipole, Da:	4.37
IP(EA), eV:	-8.7(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-2-(tert-butylamino)-1-cyclohexyl-2-oxoethyl]-N-hexylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCCCN([C@H](C1=CC(=C(C=C1)O)OC)C(=O)NCCCC)C(=O)COC

DOS

IR

Vibrations