Geometry & MOs

Info

ID:	265915
PubChem CID:	103556441
Reduced:	ClNOSC13H20 (1)
Stoich.:	ABCDE13F20 (1)
Weight, g/mol:	351.00593
ΔH_f, kcal/mol:	-28.72
Dipole, Da:	1.62
IP(EA), eV:	-9.01(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-4-chlorothiophen-2-yl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine

Drug info:

PubChemData

Smile

CCNC(CC1(CCC1)OC)C2=C(C=CS2)Cl

DOS

IR

Vibrations