Geometry & MOs

Info

ID:	294619
PubChem CID:	117474529
Reduced:	BrN3C13H16 (1)
Stoich.:	AB3C13D16 (1)
Weight, g/mol:	293.05276
ΔH_f, kcal/mol:	42.14
Dipole, Da:	3.37
IP(EA), eV:	-8.67(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-1-methyl-7-(pyrrolidin-2-ylmethyl)indazole

Drug info:

PubChemData

Smile

C1CCC(CC1)(C2=CC=CC3=NNC(=C32)Br)N

DOS

IR

Vibrations