Geometry & MOs

Info

ID:	398154
PubChem CID:	135032035
Reduced:	PN2S2O6H23C24 (1)
Stoich.:	AB2C2D6E23F24 (1)
Weight, g/mol:	729.26863
ΔH_f, kcal/mol:	-176.82
Dipole, Da:	2.5
IP(EA), eV:	-8.75(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-[[3,5-bis[[2-methoxy-6-(1,3-oxazol-5-yl)phenoxy]methyl]-2,4,6-trimethylphenyl]methoxy]-3-methoxyphenyl]-1,3-oxazole

Drug info:

PubChemData

Smile

CC1=CC2=CC=CC=C2C3=C1OP(=NS(=O)(=O)C)(OC4=C3C5=CC=CC=C5C=C4C)NS(=O)(=O)C

DOS

IR

Vibrations