Geometry & MOs

Info

ID:	396466
PubChem CID:	135028489
Reduced:	NO5C23H25 (1)
Stoich.:	AB5C23D25 (1)
Weight, g/mol:	342.02554
ΔH_f, kcal/mol:	-138.38
Dipole, Da:	6.52
IP(EA), eV:	-9.23(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-bromoethenyl)-3,3-diphenyloxolan-2-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C(CC=C)[C@@H](C1=CN=CC=C1)C2=CC3=C(C=C2C=O)OCO3

DOS

IR

Vibrations