Geometry & MOs

Info

ID:	279225
PubChem CID:	103842171
Reduced:	BrClON2H12C15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	312.96175
ΔH_f, kcal/mol:	10.95
Dipole, Da:	2.73
IP(EA), eV:	-9.82(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-(2-methylpyrazol-3-yl)benzamide

Drug info:

PubChemData

Smile

C1CN(CC2=C1N=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)Br

DOS

IR

Vibrations