Geometry & MOs

Info

ID:	395140
PubChem CID:	135024731
Reduced:	BNO4C21H26 (1)
Stoich.:	ABC4D21E26 (1)
Weight, g/mol:	367.195489
ΔH_f, kcal/mol:	-210.35
Dipole, Da:	4.88
IP(EA), eV:	-8.73(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(R)-(2-methoxyphenyl)-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]benzamide

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)[C@H](C2=CC(=CC=C2)OC)NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations