Geometry & MOs

Info

ID:	124330
PubChem CID:	50879174
Reduced:	BrO3H11C13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	297.93962
ΔH_f, kcal/mol:	-70.53
Dipole, Da:	1.21
IP(EA), eV:	-9.29(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromo-2-methylphenyl)furan-2-carbonyl chloride

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)C2=CC=C(O2)C(=O)OC

DOS

IR

Vibrations