Geometry & MOs

Info

ID:	373013
PubChem CID:	131308579
Reduced:	ON2C13H20 (1)
Stoich.:	AB2C13D20 (1)
Weight, g/mol:	199.98368
ΔH_f, kcal/mol:	-30.39
Dipole, Da:	3.47
IP(EA), eV:	-8.45(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-3-cyclopent-2-en-1-ylidenepropanal

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)[C@@H](C)N2CCNCC2)O

DOS

IR

Vibrations