Geometry & MOs

Info

ID:	413613
PubChem CID:	135086562
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	252.107008
ΔH_f, kcal/mol:	-28.33
Dipole, Da:	5.4
IP(EA), eV:	-8.41(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-benzylpyrrolo[2,3-b]pyridin-3-yl)boronic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC=C2CCC(=NOC(=O)C)C

DOS

IR

Vibrations