Geometry & MOs

Info

ID:	404112
PubChem CID:	135065013
Reduced:	PBr2O3H21C23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	244.084792
ΔH_f, kcal/mol:	-95.03
Dipole, Da:	2.08
IP(EA), eV:	-9.67(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-imidazol-2-yl-[(2R)-5-methoxy-2,3-dihydro-1-benzofuran-2-yl]methanone

Drug info:

PubChemData

Smile

CCOP(=O)(CC(C1=CC=C(C=C1)Br)C(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

DOS

IR

Vibrations