Geometry & MOs

Info

ID:	286675
PubChem CID:	104179673
Reduced:	FNOSC15H22 (1)
Stoich.:	ABCDE15F22 (1)
Weight, g/mol:	291.109314
ΔH_f, kcal/mol:	-78.2
Dipole, Da:	2.66
IP(EA), eV:	-8.6(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(3-fluorophenyl)cyclobutyl]amino]-1-thiophen-3-ylethanol

Drug info:

PubChemData

Smile

CC(C(CO)SC)NC1CC(C1)C2=CC=CC=C2F

DOS

IR

Vibrations