Geometry & MOs

Info

ID:	392969
PubChem CID:	135018728
Reduced:	N2O3C18H20 (1)
Stoich.:	A2B3C18D20 (1)
Weight, g/mol:	258.107836
ΔH_f, kcal/mol:	-12.47
Dipole, Da:	5.4
IP(EA), eV:	-8.56(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-3-phenyl-1-thiophen-2-ylcyclobutan-1-ol

Drug info:

PubChemData

Smile

CC(C1C2=CC=CC=C2CCN1C3=CC(=CC=C3)OC)[N+](=O)[O-]

DOS

IR

Vibrations