Geometry & MOs

Info

ID:	275921
PubChem CID:	103819136
Reduced:	BrON2H11C13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	294.99564
ΔH_f, kcal/mol:	0.12
Dipole, Da:	4.25
IP(EA), eV:	-9.19(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromopyridin-3-yl)-3,5-dimethyl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NC2=C(N=CC=C2)Br

DOS

IR

Vibrations