Geometry & MOs

Info

ID:	397244
PubChem CID:	135029947
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	224.120115
ΔH_f, kcal/mol:	-134.0
Dipole, Da:	2.41
IP(EA), eV:	-9.35(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tetracyclo[8.6.0.02,7.011,16]hexadeca-1(10),2,4,6,8-pentaen-11-ol

Drug info:

PubChemData

Smile

CC1=C(N=C(C(=N1)[C@@H]2COCCO2)C)[C@@H]3COCCO3

DOS

IR

Vibrations