Geometry & MOs

Info

ID:	134864
PubChem CID:	51770643
Reduced:	N2O3C23H36 (1)
Stoich.:	A2B3C23D36 (1)
Weight, g/mol:	418.319543
ΔH_f, kcal/mol:	-164.97
Dipole, Da:	2.68
IP(EA), eV:	-8.98(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-ethyl-N-[(1S)-1-(4-hydroxyphenyl)-2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]-N-methylhexanamide

Drug info:

PubChemData

Smile

CCCC[C@H](CC)C(=O)N(C)[C@H](C1=CC=C(C=C1)O)C(=O)NC2CCCCC2

DOS

IR

Vibrations