Geometry & MOs

Info

ID:	214818
PubChem CID:	85083694
Reduced:	BBrN3O5C30H43 (1)
Stoich.:	ABC3D5E30F43 (1)
Weight, g/mol:	616.19765
ΔH_f, kcal/mol:	-299.31
Dipole, Da:	6.38
IP(EA), eV:	-9.45(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,4-diacetyloxy-5-azido-6-[(3,4-diacetyloxy-5-azido-6-methoxyoxan-2-yl)methoxy]oxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

B1(OC2CC3CC(C3(C)C)C2(O1)C)C(CCCBr)NC(=O)C4CCCN4C(=O)C(CC5=CC=CC=C5)NC(=O)C

DOS

IR

Vibrations