Geometry & MOs

Info

ID:	143204
PubChem CID:	53164001
Reduced:	FON3H16C17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	332.163711
ΔH_f, kcal/mol:	-13.66
Dipole, Da:	4.85
IP(EA), eV:	-8.79(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-propylindazol-3-yl)methyl]-1H-indole-4-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C(=N1)CNC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations