Geometry & MOs

Info

ID:	61990
PubChem CID:	26716699
Reduced:	FNO4H18C19 (1)
Stoich.:	ABC4D18E19 (1)
Weight, g/mol:	404.140593
ΔH_f, kcal/mol:	-143.3
Dipole, Da:	2.5
IP(EA), eV:	-8.67(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4-[[4-(propan-2-ylsulfamoyl)benzoyl]amino]benzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)NC(=O)/C=C/C2=CC3=C(C(=C2)OC)OCCO3

DOS

IR

Vibrations