Geometry & MOs

Info

ID:	405862
PubChem CID:	135075740
Reduced:	NO2C14H17 (1)
Stoich.:	AB2C14D17 (1)
Weight, g/mol:	148.125201
ΔH_f, kcal/mol:	-63.06
Dipole, Da:	3.74
IP(EA), eV:	-8.34(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z)-5-prop-2-ynylcyclooctene

Drug info:

PubChemData

Smile

CC1=CN([C@H](CO1)CC2=CC=CC=C2)C(=O)C

DOS

IR

Vibrations