Geometry & MOs

Info

ID:	185121
PubChem CID:	77257759
Reduced:	FN4O4C24H29 (1)
Stoich.:	AB4C4D24E29 (1)
Weight, g/mol:	476.149598
ΔH_f, kcal/mol:	-215.14
Dipole, Da:	3.6
IP(EA), eV:	-8.49(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-carbamoyl-5-methyl-2-(2-methyl-3-oxopyridazin-4-yl)phenyl]-4-(4-fluorophenyl)-2-oxo-3,4-dihydropyridine-5-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(NC(=C1C(=O)NCCCNC(=O)OC(C)(C)C)C)C=C2C3=C(C=CC(=C3)F)NC2=O

DOS

IR

Vibrations