Geometry & MOs

Info

ID:	184831
PubChem CID:	77215684
Reduced:	N2O5C24H38 (1)
Stoich.:	A2B5C24D38 (1)
Weight, g/mol:	410.175419
ΔH_f, kcal/mol:	-247.1
Dipole, Da:	5.65
IP(EA), eV:	-8.72(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-N-[3-hydroxy-1-(2-oxopiperidin-4-yl)propyl]indazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC2CCCCC2.C1=CC=C(C=C1)COC(=O)NC(CCO)C(=O)O

DOS

IR

Vibrations