Geometry & MOs

Info

ID:	266454
PubChem CID:	103567071
Reduced:	O2N3C14H15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	245.05105
ΔH_f, kcal/mol:	10.09
Dipole, Da:	4.59
IP(EA), eV:	-9.28(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-5-(thiophen-3-ylmethoxy)benzonitrile

Drug info:

PubChemData

Smile

CN1C(=CC=N1)CCOC2=CC(=CC(=C2)OC)C#N

DOS

IR

Vibrations