Geometry & MOs

Info

ID:	379271
PubChem CID:	134356985
Reduced:	N3C14H14 (2)
Stoich.:	A3B14C14 (2)
Weight, g/mol:	256.062948
ΔH_f, kcal/mol:	119.41
Dipole, Da:	5.39
IP(EA), eV:	-8.46(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(cyclobutyl-hydroxy-methylidene-lambda5-phosphanyl)-1-hydroxypropyl]phosphonic acid

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@@H](N1)C)C2=NC=C(C=C2)C3=CC4=NC=C(N4C=C3)C5=CC(=NC6=CC=CC=C65)C

DOS

IR

Vibrations