Geometry & MOs

Info

ID:	187317
PubChem CID:	77558235
Reduced:	O3N4C26H30 (1)
Stoich.:	A3B4C26D30 (1)
Weight, g/mol:	496.106413
ΔH_f, kcal/mol:	-59.69
Dipole, Da:	3.41
IP(EA), eV:	-8.43(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-[3-(acetylsulfamoyl)-2-oxopyridin-1-yl]-2-fluorophenyl]carbamoyl]-4-methoxypyrrolidine-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1CCC(N1C(=O)O)(C(=O)NC2=NN(C=C2C3=CC=CC=C3)C4=CC=CC=C4)C(C)(C)C

DOS

IR

Vibrations