Geometry & MOs

Info

ID:	324010
PubChem CID:	126676758
Reduced:	N3O3C13H17 (1)
Stoich.:	A3B3C13D17 (1)
Weight, g/mol:	272.081361
ΔH_f, kcal/mol:	-107.59
Dipole, Da:	1.41
IP(EA), eV:	-9.63(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(1-dihydroxyphosphanyloxy-2-methylpropan-2-yl)benzoate

Drug info:

PubChemData

Smile

CCNC(=O)C1=CC(=CNC1=O)C(=O)N[C@H]2C[C@@H]2C

DOS

IR

Vibrations