Geometry & MOs

Info

ID:	10273
PubChem CID:	99589
Reduced:	PO4H13C20 (1)
Stoich.:	AB4C13D20 (1)
Weight, g/mol:	348.055146
ΔH_f, kcal/mol:	-141.19
Dipole, Da:	4.5
IP(EA), eV:	-8.87(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

13-hydroxy-12,14-dioxa-13lambda5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 13-oxide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=CC=CC=C54)OP(=O)(O3)O

DOS

IR

Vibrations