Geometry & MOs

Info

ID:	69719
PubChem CID:	47205243
Reduced:	ON5C14H15 (1)
Stoich.:	AB5C14D15 (1)
Weight, g/mol:	339.02185
ΔH_f, kcal/mol:	32.29
Dipole, Da:	5.56
IP(EA), eV:	-8.86(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2,5-dimethoxy-N-(1H-pyrazol-5-ylmethyl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)NC(=N2)CCC(=O)NCC3=CC=NN3

DOS

IR

Vibrations