Geometry & MOs

Info

ID:	131848
PubChem CID:	51268671
Reduced:	OSN7C19H19 (1)
Stoich.:	ABC7D19E19 (1)
Weight, g/mol:	377.01752
ΔH_f, kcal/mol:	117.86
Dipole, Da:	3.71
IP(EA), eV:	-8.54(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[(3-fluorophenyl)-(1-methylimidazol-2-yl)methyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CSCCC(C1=NN=C2N1C=CC=C2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

DOS

IR

Vibrations