Geometry & MOs

Info

ID:	438394
PubChem CID:	135228130
Reduced:	N2P2O9C17H18 (1)
Stoich.:	A2B2C9D17E18 (1)
Weight, g/mol:	297.139865
ΔH_f, kcal/mol:	-412.8
Dipole, Da:	3.42
IP(EA), eV:	-9.59(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2-hydroxypropan-2-yloxy)propyl]-N-phenylcyclopropane-1-sulfinamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)C2=C3C(=CC=C2)N(C=N3)CC(O)(P(=O)(O)O)P(=O)(O)O

DOS

IR

Vibrations