Geometry & MOs

Info

ID:	53047
PubChem CID:	14709467
Reduced:	OSeC11H16 (1)
Stoich.:	ABC11D16 (1)
Weight, g/mol:	114.982491
ΔH_f, kcal/mol:	-42.03
Dipole, Da:	3.53
IP(EA), eV:	-8.42(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyanoprop-2-enoyl chloride

Drug info:

PubChemData

Smile

CC(CCC[Se]C1=CC=CC=C1)O

DOS

IR

Vibrations