Geometry & MOs

Info

ID:	50266
PubChem CID:	12012782
Reduced:	NO6C18H25 (1)
Stoich.:	AB6C18D25 (1)
Weight, g/mol:	409.290058
ΔH_f, kcal/mol:	-242.92
Dipole, Da:	4.35
IP(EA), eV:	-10.16(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-2-[(1R)-4-azido-1-phenylbutyl]-4,5-dicyclohexyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

CCOC(=O)/C=C/1\[C@H]2C=C[C@@H](C1C(=O)OCC)N2C(=O)OC(C)(C)C

DOS

IR

Vibrations