Geometry & MOs

Info

ID:	372891
PubChem CID:	131306610
Reduced:	BrO2C10H17 (1)
Stoich.:	AB2C10D17 (1)
Weight, g/mol:	150.115698
ΔH_f, kcal/mol:	-110.11
Dipole, Da:	2.98
IP(EA), eV:	-9.77(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-piperidin-3-ylbut-3-enenitrile

Drug info:

PubChemData

Smile

C1CC2(CCOCC2)COC1CBr

DOS

IR

Vibrations