Geometry & MOs

Info

ID:	259577
PubChem CID:	103168537
Reduced:	BrNSC12H18 (1)
Stoich.:	ABCD12E18 (1)
Weight, g/mol:	261.209264
ΔH_f, kcal/mol:	21.55
Dipole, Da:	2.33
IP(EA), eV:	-9.03(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-ethoxycyclobutyl)-5-phenylpentan-2-amine

Drug info:

PubChemData

Smile

CNC(CC1CCC1)CC2=CC(=CS2)Br

DOS

IR

Vibrations