Geometry & MOs

Info

ID:	271019
PubChem CID:	103640345
Reduced:	BrClON4H8C14 (1)
Stoich.:	ABCD4E8F14 (1)
Weight, g/mol:	286.03169
ΔH_f, kcal/mol:	65.77
Dipole, Da:	1.81
IP(EA), eV:	-9.33(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-2-methoxyphenyl)-2-(dimethylamino)acetamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(C(=N2)Cl)NC(=O)C3=NC=C(C=C3)Br

DOS

IR

Vibrations