Geometry & MOs

Info

ID:	293947
PubChem CID:	117418824
Reduced:	ClNOC15H20 (1)
Stoich.:	ABCD15E20 (1)
Weight, g/mol:	264.955
ΔH_f, kcal/mol:	-17.56
Dipole, Da:	2.65
IP(EA), eV:	-9.03(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-(3-bromo-2,5-difluoro-6-hydroxyphenyl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)Cl)OCC2CC2)C3(CCC3)N

DOS

IR

Vibrations