Geometry & MOs

Info

ID:	276628
PubChem CID:	103824527
Reduced:	BrClNOC13H13 (1)
Stoich.:	ABCDE13F13 (1)
Weight, g/mol:	316.98182
ΔH_f, kcal/mol:	-24.58
Dipole, Da:	6.44
IP(EA), eV:	-9.04(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-chlorophenyl)-5-methyloxolane-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(CC=C1)C(=O)NC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations