Geometry & MOs

Info

ID:	89711
PubChem CID:	49963974
Reduced:	NSO2H9C12 (1)
Stoich.:	ABC2D9E12 (1)
Weight, g/mol:	218.076536
ΔH_f, kcal/mol:	2.19
Dipole, Da:	2.39
IP(EA), eV:	-9.33(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dimethylphenyl)-thiophen-2-ylmethanol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(O2)C(C3=CC=CS3)O

DOS

IR

Vibrations