Geometry & MOs

Info

ID:	400004
PubChem CID:	135044438
Reduced:	N2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	265.99424
ΔH_f, kcal/mol:	-26.13
Dipole, Da:	4.37
IP(EA), eV:	-10.59(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-3-(3-bromophenyl)-4-ethenyloxolan-2-one

Drug info:

PubChemData

Smile

CC(C(=C)C(CC=C)(C#N)C#N)OC(=O)C(C)(C)C

DOS

IR

Vibrations