Geometry & MOs

Info

ID:	194663
PubChem CID:	78571073
Reduced:	BrSF3N3H9C12 (1)
Stoich.:	ABC3D3E9F12 (1)
Weight, g/mol:	383.220892
ΔH_f, kcal/mol:	-68.44
Dipole, Da:	5.56
IP(EA), eV:	-8.97(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-hexoxyphenyl)methylideneamino]-2-(2-methoxyanilino)acetamide

Drug info:

PubChemData

Smile

CC(=NNC1=NC=C(C=C1)C(F)(F)F)C2=CC=C(S2)Br

DOS

IR

Vibrations