Geometry & MOs

Info

ID:	409636
PubChem CID:	135082418
Reduced:	BNC20H24 (1)
Stoich.:	ABC20D24 (1)
Weight, g/mol:	317.23148
ΔH_f, kcal/mol:	6.02
Dipole, Da:	2.66
IP(EA), eV:	-8.8(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,5R)-2,5-diphenyl-N,N-di(propan-2-yl)-2,5-dihydroborol-1-amine

Drug info:

PubChemData

Smile

B1([C@H](C=C[C@@H]1C2=CC=CC=C2)C3=CC=CC=C3)N(CC)CC

DOS

IR

Vibrations