Geometry & MOs

Info

ID:	24728
PubChem CID:	612779
Reduced:	NO2C18H23 (1)
Stoich.:	AB2C18D23 (1)
Weight, g/mol:	285.172879
ΔH_f, kcal/mol:	-10.25
Dipole, Da:	2.93
IP(EA), eV:	-8.25(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dimethoxy-2-prop-2-ynylspiro[1,3-dihydroisoquinoline-4,1'-cyclopentane]

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)CN(CC23CCCC3)CC#C)OC

DOS

IR

Vibrations