Geometry & MOs

Info

ID:	32227
PubChem CID:	6435995
Reduced:	N4C8H15 (2)
Stoich.:	A4B8C15 (2)
Weight, g/mol:	491.339944
ΔH_f, kcal/mol:	84.52
Dipole, Da:	0.02
IP(EA), eV:	-9.29(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,4E,6Z,8E,10E,12R,13R,14E,16S)-13-hydroxy-N-[(2S)-1-hydroxypropan-2-yl]-2,10,12,14,16-pentamethyl-18-phenyloctadeca-2,4,6,8,10,14-hexaenamide

Drug info:

PubChemData

Smile

C1N2CN3CN1C[N+](C2)(C3)C/C=C/C[N+]45CN6CN(C4)CN(C6)C5

DOS

IR

Vibrations