Geometry & MOs

Info

ID:	69406
PubChem CID:	47169938
Reduced:	N3O3C13H15 (1)
Stoich.:	A3B3C13D15 (1)
Weight, g/mol:	407.89657
ΔH_f, kcal/mol:	-58.35
Dipole, Da:	8.88
IP(EA), eV:	-9.35(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dibromo-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CN(C)C(=O)C2=CC=CNC2=O

DOS

IR

Vibrations