Geometry & MOs

Info

ID:	251508
PubChem CID:	103104504
Reduced:	O3N7C8H13 (1)
Stoich.:	A3B7C8D13 (1)
Weight, g/mol:	286.03169
ΔH_f, kcal/mol:	6.0
Dipole, Da:	4.31
IP(EA), eV:	-9.78(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-bromo-2-hydroxyphenyl)methyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C1=NC=NC(=C1[N+](=O)[O-])NN

DOS

IR

Vibrations