Geometry & MOs

Info

ID:	182679
PubChem CID:	76922734
Reduced:	BrN3O3C11H14 (1)
Stoich.:	AB3C3D11E14 (1)
Weight, g/mol:	217.017353
ΔH_f, kcal/mol:	-67.39
Dipole, Da:	3.38
IP(EA), eV:	-9.48(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-amino-2-(2,6-dichlorophenyl)ethanimidamide

Drug info:

PubChemData

Smile

CN(CCC(=NO)N)C(=O)C1=C(C=C(C=C1)Br)O

DOS

IR

Vibrations