Geometry & MOs

Info

ID:	277060
PubChem CID:	103826541
Reduced:	BrClON4H10C11 (1)
Stoich.:	ABCD4E10F11 (1)
Weight, g/mol:	340.99305
ΔH_f, kcal/mol:	24.43
Dipole, Da:	3.41
IP(EA), eV:	-10.15(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-(1-pyrazol-1-ylpropan-2-yl)benzamide

Drug info:

PubChemData

Smile

CN1C=NN=C1CNC(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations