Geometry & MOs

Info

ID:	381230
PubChem CID:	134971897
Reduced:	O6H38C45 (1)
Stoich.:	A6B38C45 (1)
Weight, g/mol:	570.240624
ΔH_f, kcal/mol:	-96.98
Dipole, Da:	3.87
IP(EA), eV:	-9.33(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[(5R)-5-[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-diphenylmethyl] benzoate

Drug info:

PubChemData

Smile

CC1(O[C@H](C(O1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C(C5=CC=CC=C5)(C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)C

DOS

IR

Vibrations