Geometry & MOs

Info

ID:	375230
PubChem CID:	131480972
Reduced:	BrNOC12H14 (1)
Stoich.:	ABCD12E14 (1)
Weight, g/mol:	154.090627
ΔH_f, kcal/mol:	-4.11
Dipole, Da:	2.36
IP(EA), eV:	-8.67(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-fluoro-3-piperidin-4-ylprop-2-enenitrile

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C/2\CCNC2)Br

DOS

IR

Vibrations