Geometry & MOs

Info

ID:	186966
PubChem CID:	77508494
Reduced:	ON2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	398.318481
ΔH_f, kcal/mol:	-3.22
Dipole, Da:	6.28
IP(EA), eV:	-9.74(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,9,13-trimethyl-5'-methylidenespiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]

Drug info:

PubChemData

Smile

CCCCN1C2C(C(=O)NC1=O)N=CN2CC3=CC=CC=C3

DOS

IR

Vibrations