Geometry & MOs

Info

ID:	77019
PubChem CID:	48425713
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	372.05071
ΔH_f, kcal/mol:	-112.83
Dipole, Da:	4.36
IP(EA), eV:	-8.22(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-bromophenyl)sulfanyl-N-[2-(diethylamino)-2-oxoethyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CCCOC1=CC=CC2=CC=CC=C21

DOS

IR

Vibrations