Geometry & MOs

Info

ID:	122065
PubChem CID:	50792456
Reduced:	FO3N5C24H32 (1)
Stoich.:	AB3C5D24E32 (1)
Weight, g/mol:	537.122212
ΔH_f, kcal/mol:	-146.57
Dipole, Da:	5.64
IP(EA), eV:	-9.62(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-chloro-2-(4-ethylphenyl)-3-oxo-4H-chromeno[2,3-c]pyrazol-1-yl]-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CCCN1C(=O)C2=C(N=CN2CC1(C)C(=O)NCCC(C)C)C(=O)NCC3=CC(=CC=C3)F

DOS

IR

Vibrations