Geometry & MOs

Info

ID:	134158
PubChem CID:	51655506
Reduced:	NO2C11H14 (2)
Stoich.:	AB2C11D14 (2)
Weight, g/mol:	216.990511
ΔH_f, kcal/mol:	-158.84
Dipole, Da:	4.23
IP(EA), eV:	-8.76(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

[(3S)-3-azaniumyl-3-phosphonatopropyl]-hydroxyphosphinate

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)NCC1=CC(=CC=C1)OC)N2C(=O)[C@@H]3CC=CC[C@@H]3C2=O

DOS

IR

Vibrations