Geometry & MOs

Info

ID:	262422
PubChem CID:	103292662
Reduced:	BrClN2O2H12C14 (1)
Stoich.:	ABC2D2E12F14 (1)
Weight, g/mol:	271.108754
ΔH_f, kcal/mol:	-29.01
Dipole, Da:	5.15
IP(EA), eV:	-9.31(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chloro-6-methoxyphenyl)methylamino]-N'-hydroxybutanimidamide

Drug info:

PubChemData

Smile

COC1=C(C(=CC=C1)Cl)CNC(=O)C2=NC=C(C=C2)Br

DOS

IR

Vibrations