Geometry & MOs

Info

ID:	13808
PubChem CID:	398527
Reduced:	BrN3O3C10H10 (1)
Stoich.:	AB3C3D10E10 (1)
Weight, g/mol:	298.99055
ΔH_f, kcal/mol:	-112.69
Dipole, Da:	5.96
IP(EA), eV:	-9.61(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-bromoacetyl)amino]-N-carbamoylbenzamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)NC(=O)N)NC(=O)CBr

DOS

IR

Vibrations