Geometry & MOs

Info

ID:	58392
PubChem CID:	24698175
Reduced:	NOSC6H6 (2)
Stoich.:	ABCD6E6 (2)
Weight, g/mol:	233.152812
ΔH_f, kcal/mol:	-26.4
Dipole, Da:	8.9
IP(EA), eV:	-8.0(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-3-(piperidin-1-ylmethyl)benzenecarboximidamide

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C2=NC(=S)C(=C(N2)C)C(=O)OC

DOS

IR

Vibrations