Geometry & MOs

Info

ID:	275927
PubChem CID:	103819217
Reduced:	BrON2H13C14 (1)
Stoich.:	ABC2D13E14 (1)
Weight, g/mol:	298.06808
ΔH_f, kcal/mol:	-8.8
Dipole, Da:	2.86
IP(EA), eV:	-9.22(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromopyridin-3-yl)-3,4,4-trimethylpentanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations