Geometry & MOs

Info

ID:	18762
PubChem CID:	547500
Reduced:	NSO2C15H17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	275.098
ΔH_f, kcal/mol:	-49.28
Dipole, Da:	4.51
IP(EA), eV:	-8.46(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[(dimethylamino)methyl]phenyl]sulfanylbenzene-1,3-diol

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1SC2=C(C=C(C=C2)O)O

DOS

IR

Vibrations