Geometry & MOs

Info

ID:	373203
PubChem CID:	131311463
Reduced:	BrClNO2C9H11 (1)
Stoich.:	ABCD2E9F11 (1)
Weight, g/mol:	299.93643
ΔH_f, kcal/mol:	-77.84
Dipole, Da:	0.58
IP(EA), eV:	-9.73(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-2-(chloromethyl)-3-(difluoromethoxy)-5-methoxybenzene

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Br)[C@H]([C@H](CO)O)N

DOS

IR

Vibrations