Geometry & MOs

Info

ID:	403378
PubChem CID:	135059927
Reduced:	ClNOC10H14 (1)
Stoich.:	ABCD10E14 (1)
Weight, g/mol:	214.110613
ΔH_f, kcal/mol:	-41.79
Dipole, Da:	3.93
IP(EA), eV:	-9.02(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-acetyl-4-anilinopent-3-enenitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@H](C=C)[NH3+].[Cl-]

DOS

IR

Vibrations