Geometry & MOs

Info

ID:	79744
PubChem CID:	49830230
Reduced:	NO4C19H19 (1)
Stoich.:	AB4C19D19 (1)
Weight, g/mol:	523.14705
ΔH_f, kcal/mol:	-100.06
Dipole, Da:	3.82
IP(EA), eV:	-8.27(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[2-(4-bromoanilino)-2-oxoethoxy]phenyl]methylamino]-N-(4-tert-butylphenyl)acetamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C=CC(=O)NC2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations