Geometry & MOs

Info

ID:	372620
PubChem CID:	131301041
Reduced:	BrOF5H6C9 (1)
Stoich.:	ABC5D6E9 (1)
Weight, g/mol:	380.92252
ΔH_f, kcal/mol:	-281.97
Dipole, Da:	1.34
IP(EA), eV:	-10.23(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-(5-bromo-3-iodo-2-methoxyphenyl)-cyclopropylmethanamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Br)C(F)(F)F)C(C(F)F)O

DOS

IR

Vibrations