Geometry & MOs

Info

ID:	387924
PubChem CID:	134987423
Reduced:	NSO2C9H17 (1)
Stoich.:	ABC2D9E17 (1)
Weight, g/mol:	292.04628
ΔH_f, kcal/mol:	-87.19
Dipole, Da:	9.59
IP(EA), eV:	-9.03(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-2-(1-bromo-4-phenylbutylidene)cyclopentan-1-one

Drug info:

PubChemData

Smile

CC(C)(C)C1=CS(=O)(=O)CCN1C

DOS

IR

Vibrations