Geometry & MOs

Info

ID:	61993
PubChem CID:	26716737
Reduced:	N2O3H18C20 (1)
Stoich.:	A2B3C18D20 (1)
Weight, g/mol:	404.140593
ΔH_f, kcal/mol:	-48.68
Dipole, Da:	4.11
IP(EA), eV:	-9.3(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4-[[5-(ethylsulfamoyl)-2-methylbenzoyl]amino]benzoate

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=CC=C(C=C2)C#N

DOS

IR

Vibrations