Geometry & MOs

Info

ID:	407735
PubChem CID:	135080490
Reduced:	NO2H11C12 (1)
Stoich.:	AB2C11D12 (1)
Weight, g/mol:	244.055801
ΔH_f, kcal/mol:	-30.24
Dipole, Da:	5.46
IP(EA), eV:	-8.27(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(hydroxymethyl)dibenzothiophen-2-yl]methanol

Drug info:

PubChemData

Smile

COC\1=CC=CC(=O)/C1=C\2/C=CC=CN2

DOS

IR

Vibrations