Geometry & MOs

Info

ID:	265913
PubChem CID:	103556439
Reduced:	ClNOSC11H16 (1)
Stoich.:	ABCDE11F16 (1)
Weight, g/mol:	259.079763
ΔH_f, kcal/mol:	-28.82
Dipole, Da:	3.34
IP(EA), eV:	-9.3(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorothiophen-2-yl)-2-(1-methoxycyclobutyl)-N-methylethanamine

Drug info:

PubChemData

Smile

COC1(CCC1)CC(C2=C(C=CS2)Cl)N

DOS

IR

Vibrations