Geometry & MOs

Info

ID:	224897
PubChem CID:	85645418
Reduced:	SO2N3H7C9 (1)
Stoich.:	AB2C3D7E9 (1)
Weight, g/mol:	145.127409
ΔH_f, kcal/mol:	69.95
Dipole, Da:	3.22
IP(EA), eV:	-9.52(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-aminohexylboronic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)C#N

DOS

IR

Vibrations