Geometry & MOs

Info

ID:	139054
PubChem CID:	52465845
Reduced:	O2N3C17H19 (1)
Stoich.:	A2B3C17D19 (1)
Weight, g/mol:	429.9861
ΔH_f, kcal/mol:	-15.38
Dipole, Da:	4.17
IP(EA), eV:	-8.63(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(4-bromophenyl)-[3-(pyridin-2-ylcarbamoyl)phenyl]sulfonylazanide

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)OC2=NC=C(C=C2)NC(=O)NCC=C

DOS

IR

Vibrations