Geometry & MOs

Info

ID:	148878
PubChem CID:	53788548
Reduced:	NPO5C19H40 (1)
Stoich.:	ABC5D19E40 (1)
Weight, g/mol:	376.182064
ΔH_f, kcal/mol:	-349.03
Dipole, Da:	1.12
IP(EA), eV:	-9.69(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(5-anilinopentan-2-ylamino)-1-hydroxyethyl]-2-methylsulfinylphenol

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC=C(C)C(C(COP(=O)(O)O)N)O

DOS

IR

Vibrations