Geometry & MOs

Info

ID:	76790
PubChem CID:	48425390
Reduced:	SCl2N2O2C15H20 (1)
Stoich.:	AB2C2D2E15F20 (1)
Weight, g/mol:	370.08921
ΔH_f, kcal/mol:	-102.09
Dipole, Da:	3.23
IP(EA), eV:	-9.08(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[2-(diethylamino)-2-oxoethyl]-2-propan-2-yloxybenzamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CSCC1=C(C=C(C=C1)Cl)Cl

DOS

IR

Vibrations