Geometry & MOs

Info

ID:	29588
PubChem CID:	835542
Reduced:	NO5C14H21 (1)
Stoich.:	AB5C14D21 (1)
Weight, g/mol:	293.00514
ΔH_f, kcal/mol:	-222.44
Dipole, Da:	1.89
IP(EA), eV:	-8.5(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(2-ethylphenyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N[C@H]2[C@@H]([C@H]([C@@H](O2)[C@@H](CO)O)O)O)C

DOS

IR

Vibrations