Geometry & MOs

Info

ID:	148700
PubChem CID:	53788369
Reduced:	O3N6C32H58 (1)
Stoich.:	A3B6C32D58 (1)
Weight, g/mol:	247.04289
ΔH_f, kcal/mol:	-169.42
Dipole, Da:	3.19
IP(EA), eV:	-8.5(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-(4-hydroxyphenyl)-4-methylbenzenesulfinate

Drug info:

PubChemData

Smile

CCN(CCNC(=O)C1=CC(=CC(=C1)C(=O)NCCN(C(C)C)C(C)C)C(=O)NCCN(C(C)C)C(C)C)C(C)C

DOS

IR

Vibrations