Geometry & MOs

Info

ID:	185891
PubChem CID:	77366074
Reduced:	O4N6C13H18 (1)
Stoich.:	A4B6C13D18 (1)
Weight, g/mol:	410.209324
ΔH_f, kcal/mol:	-86.6
Dipole, Da:	3.82
IP(EA), eV:	-8.43(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,11-diphenyl-5,12,13,16-tetraoxadispiro[5.0.57.46]hexadecan-14-yl)methanol

Drug info:

PubChemData

Smile

CN(C)C=C(C1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O)O

DOS

IR

Vibrations