Geometry & MOs

Info

ID:	242948
PubChem CID:	99214427
Reduced:	SO2N5C23H27 (1)
Stoich.:	AB2C5D23E27 (1)
Weight, g/mol:	421.109627
ΔH_f, kcal/mol:	0.59
Dipole, Da:	8.19
IP(EA), eV:	-9.38(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyano-2-ethoxyphenyl)-4-(phenylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)N3CCC(CC3)NC(=O)C4=CSC=C4)C(C)C

DOS

IR

Vibrations