Geometry & MOs

Info

ID:	275949
PubChem CID:	103819363
Reduced:	BrOSN2C12H15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	336.01095
ΔH_f, kcal/mol:	-35.89
Dipole, Da:	1.42
IP(EA), eV:	-8.66(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CSCCC1CC(=O)NC2=C(N=CC=C2)Br

DOS

IR

Vibrations