Geometry & MOs

Info

ID:	142439
PubChem CID:	53034387
Reduced:	FN3O3H24C25 (1)
Stoich.:	AB3C3D24E25 (1)
Weight, g/mol:	403.169605
ΔH_f, kcal/mol:	-63.49
Dipole, Da:	3.11
IP(EA), eV:	-8.41(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-ethoxyphenyl)methyl]-1-[(4-fluorophenyl)methyl]indazole-6-carboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C=NN3CC4=CC=C(C=C4)F)OC

DOS

IR

Vibrations