Geometry & MOs

Info

ID:	128750
PubChem CID:	51057103
Reduced:	Cl2O2N3C16H19 (1)
Stoich.:	A2B2C3D16E19 (1)
Weight, g/mol:	536.186019
ΔH_f, kcal/mol:	-66.16
Dipole, Da:	8.56
IP(EA), eV:	-9.06(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]amino]ethyl]-2-sulfamoylbenzamide

Drug info:

PubChemData

Smile

CN(C)CCCCNC(=O)C1=CC(=O)C2=C(N1)C=C(C=C2Cl)Cl

DOS

IR

Vibrations