Geometry & MOs

Info

ID:

176355

PubChem CID:

76037010

Reduced:

NO6C28H34 (2)

Stoich.:

AB6C28D34 (2)

Weight, g/mol:

380.169585

ΔHf, kcal/mol:

-414.71

Dipole, Da:

2.81

IP(EA), eV:

 -9.22(-0.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

benzyl N-[2-(5-azido-4-hydroxy-3-methoxy-6-methyloxan-2-yl)oxyethyl]carbamate

Drug info:

PubChemData

Smile

CC1C(C(C(C(O1)OC2C(C(OC(C2OCC3=CC=CC=C3)OCCN(CC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5)C)OCC6=CC=CC=C6)OC)OCC7=CC=CC=C7)NC(=O)CC(C)(C)O

DOS

IR

Vibrations