Geometry & MOs

Info

ID:	77272
PubChem CID:	48426002
Reduced:	BrClN2O3C15H20 (1)
Stoich.:	ABC2D3E15F20 (1)
Weight, g/mol:	397.203528
ΔH_f, kcal/mol:	-126.21
Dipole, Da:	4.17
IP(EA), eV:	-9.12(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C(C)OC1=C(C=C(C=C1)Cl)Br

DOS

IR

Vibrations