Geometry & MOs

Info

ID:	280983
PubChem CID:	103852312
Reduced:	BrN2O2C11H13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	302.96617
ΔH_f, kcal/mol:	-60.99
Dipole, Da:	5.08
IP(EA), eV:	-9.14(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(2-bromo-5-chlorophenyl)oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1Br)NC(=O)[C@H]2CCCO2

DOS

IR

Vibrations