Geometry & MOs

Info

ID:	265911
PubChem CID:	103556420
Reduced:	FNOC17H26 (1)
Stoich.:	ABCD17E26 (1)
Weight, g/mol:	331.06055
ΔH_f, kcal/mol:	-87.99
Dipole, Da:	2.68
IP(EA), eV:	-8.98(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCNC(CC1(CCC1)OC)C2=CC(=C(C=C2)F)C

DOS

IR

Vibrations