Geometry & MOs

Info

ID:	32102
PubChem CID:	4266061
Reduced:	SO3F4N5H9C12 (1)
Stoich.:	AB3C4D5E9F12 (1)
Weight, g/mol:	378.09429
ΔH_f, kcal/mol:	-172.09
Dipole, Da:	5.71
IP(EA), eV:	-9.74(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenoxy)-N-[(2-pentylcyclopent-2-en-1-ylidene)amino]acetamide

Drug info:

PubChemData

Smile

CN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)F)[N+](=O)[O-])C(F)(F)F

DOS

IR

Vibrations