Geometry & MOs

Info

ID:	242878
PubChem CID:	99213552
Reduced:	O4N5C20H21 (1)
Stoich.:	A4B5C20D21 (1)
Weight, g/mol:	470.162391
ΔH_f, kcal/mol:	-62.88
Dipole, Da:	6.57
IP(EA), eV:	-9.04(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[4-[[3-(tert-butylsulfamoyl)benzoyl]amino]phenyl]pyrazole-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=NN(C=C1)C2=CC=C(C=C2)NC(=O)C(=O)C3=C(N(N=C3C)C)C

DOS

IR

Vibrations