Geometry & MOs

Info

ID:	137792
PubChem CID:	52263510
Reduced:	O3N4C20H24 (1)
Stoich.:	A3B4C20D24 (1)
Weight, g/mol:	297.111341
ΔH_f, kcal/mol:	-62.54
Dipole, Da:	6.93
IP(EA), eV:	-8.8(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-hydroxy-3-methoxyphenyl)methyl]-1H-indazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2C(=C(C(=NC2=C1)C)CCC(=O)NCC3=CC(=C(C=C3)O)OC)C

DOS

IR

Vibrations