Geometry & MOs

Info

ID:	361191
PubChem CID:	127302135
Reduced:	N3O4H21C22 (1)
Stoich.:	A3B4C21D22 (1)
Weight, g/mol:	390.06914
ΔH_f, kcal/mol:	-82.66
Dipole, Da:	6.88
IP(EA), eV:	-8.03(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-1H-indazole-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=O)C(=N1)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCCC5

DOS

IR

Vibrations