Geometry & MOs

Info

ID:	153353
PubChem CID:	56312539
Reduced:	FBr2O2N3H12C19 (1)
Stoich.:	AB2C2D3E12F19 (1)
Weight, g/mol:	428.0484
ΔH_f, kcal/mol:	-34.77
Dipole, Da:	8.22
IP(EA), eV:	-9.18(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(5-bromopyridin-2-yl)carbamoyl]phenyl]-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)NC(=O)C2=C(C=CC(=C2)F)Br)C(=O)NC3=NC=C(C=C3)Br

DOS

IR

Vibrations