Geometry & MOs

Info

ID:	410935
PubChem CID:	135083736
Reduced:	OC4H8 (2)
Stoich.:	AB4C8 (2)
Weight, g/mol:	236.108026
ΔH_f, kcal/mol:	-120.32
Dipole, Da:	4.28
IP(EA), eV:	-10.26(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(Z)-hept-6-en-2-ylideneamino]aniline

Drug info:

PubChemData

Smile

CCC[C@@H](CC(=O)CC)O

DOS

IR

Vibrations