Geometry & MOs

Info

ID:	336498
PubChem CID:	127255505
Reduced:	BN2O2C5H7 (1)
Stoich.:	AB2C2D5E7 (1)
Weight, g/mol:	245.052024
ΔH_f, kcal/mol:	-108.05
Dipole, Da:	2.94
IP(EA), eV:	-9.94(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

piperidin-2-ylmethyl carbamimidothioate;dihydrochloride

Drug info:

PubChemData

Smile

B(C1=CC(=NN=C1)C)(O)O

DOS

IR

Vibrations