Geometry & MOs

Info

ID:	222132
PubChem CID:	85294582
Reduced:	N5O13C23H45 (1)
Stoich.:	A5B13C23D45 (1)
Weight, g/mol:	842.351356
ΔH_f, kcal/mol:	-601.02
Dipole, Da:	6.23
IP(EA), eV:	-9.34(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4,5-diacetyloxy-6-methoxy-2-[[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate

Drug info:

PubChemData

Smile

C1C(C(C(C(C1NC(=O)CCC(CO)N)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(C(C(C(O3)CN)O)O)O)N

DOS

IR

Vibrations