Geometry & MOs

Info

ID:	4941
PubChem CID:	12311
Reduced:	ClC4H5 (1)
Stoich.:	AB4C5 (1)
Weight, g/mol:	88.007978
ΔH_f, kcal/mol:	19.25
Dipole, Da:	1.62
IP(EA), eV:	-9.51(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chlorobuta-1,3-diene

Drug info:

PubChemData

Smile

C=CC=CCl

DOS

IR

Vibrations