Geometry & MOs

Info

ID:	394283
PubChem CID:	135022677
Reduced:	BrO8C25H29 (1)
Stoich.:	AB8C25D29 (1)
Weight, g/mol:	457.186243
ΔH_f, kcal/mol:	-293.56
Dipole, Da:	3.92
IP(EA), eV:	-9.8(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(CBr)(OC)OC1[C@H](OC2COC(O[C@H]2C1OC(=O)C3=CC=CC=C3)C4=CC=CC=C4)OC

DOS

IR

Vibrations