Geometry & MOs

Info

ID:	315446
PubChem CID:	126626741
Reduced:	BrOF3H16C19 (1)
Stoich.:	ABC3D16E19 (1)
Weight, g/mol:	205.121512
ΔH_f, kcal/mol:	-141.46
Dipole, Da:	4.27
IP(EA), eV:	-8.93(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(Z)-1-amino-3-methyliminoprop-1-en-2-yl]-3-methoxyaniline

Drug info:

PubChemData

Smile

C1CC1C2=CC=C(C=C2)OC3CCC4=C3C=CC(=C4Br)C(F)(F)F

DOS

IR

Vibrations