Geometry & MOs

Info

ID:	275953
PubChem CID:	103819423
Reduced:	BrOSN2H9C11 (1)
Stoich.:	ABCD2E9F11 (1)
Weight, g/mol:	290.00548
ΔH_f, kcal/mol:	4.59
Dipole, Da:	3.98
IP(EA), eV:	-9.17(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromopyridin-3-yl)-2-methylbenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations