Geometry & MOs

Info

ID:	146099
PubChem CID:	53635306
Reduced:	P2C3H8O9 (1)
Stoich.:	A2B3C8D9 (1)
Weight, g/mol:	390.148061
ΔH_f, kcal/mol:	-529.51
Dipole, Da:	4.52
IP(EA), eV:	-11.6(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,5,5-tetrapyridin-2-ylpenta-1,4-dien-3-one

Drug info:

PubChemData

Smile

CC(C(=O)OP(=O)(O)OP(=O)(O)O)O

DOS

IR

Vibrations