Geometry & MOs

Info

ID:	218631
PubChem CID:	85089723
Reduced:	F2N3O4C26H31 (1)
Stoich.:	A2B3C4D26E31 (1)
Weight, g/mol:	487.260144
ΔH_f, kcal/mol:	-230.63
Dipole, Da:	5.21
IP(EA), eV:	-9.64(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[tert-butyl(dimethyl)silyl]oxy-1-(2,5-dimethoxy-3-nitrophenyl)-1,5-dimethoxy-2-methylhexan-3-ol

Drug info:

PubChemData

Smile

C1CCC(CC1)C(C(=O)NC2CCC(CC2)NC(=O)C3=C(N=CC(=C3)F)OC4=CC=C(C=C4)F)O

DOS

IR

Vibrations