Geometry & MOs

Info

ID:	339478
PubChem CID:	127261411
Reduced:	NO2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	378.98778
ΔH_f, kcal/mol:	-75.36
Dipole, Da:	6.32
IP(EA), eV:	-8.52(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-2-(4-bromophenyl)-1-(4-methylphenyl)sulfonylethenyl]formamide

Drug info:

PubChemData

Smile

CCOC1=C/C(=C/CNC=O)/CCC1

DOS

IR

Vibrations