Geometry & MOs

Info

ID:	61758
PubChem CID:	26712569
Reduced:	SN3O4C21H27 (1)
Stoich.:	AB3C4D21E27 (1)
Weight, g/mol:	459.182792
ΔH_f, kcal/mol:	-137.32
Dipole, Da:	4.28
IP(EA), eV:	-9.26(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(E)-3-[3-(dimethylsulfamoyl)-4-methoxyphenyl]prop-2-enoyl]amino]-N,N-diethylbenzamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC(C)C

DOS

IR

Vibrations