Geometry & MOs

Info

ID:	217529
PubChem CID:	85087948
Reduced:	PO4N6C14H25 (1)
Stoich.:	AB4C6D14E25 (1)
Weight, g/mol:	372.120903
ΔH_f, kcal/mol:	-170.8
Dipole, Da:	5.9
IP(EA), eV:	-9.15(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-methyl-8-propan-2-yl-2,5,9,12,19-pentaoxaoctacyclo[12.7.0.01,3.04,6.06,13.08,10.011,13.017,21]henicos-17(21)-ene-7,18-dione

Drug info:

PubChemData

Smile

CC(C)OP(=O)(COC(C)CN1C=NC2=C(N=NN=C21)N)OC(C)C

DOS

IR

Vibrations