Geometry & MOs

Info

ID:	259625
PubChem CID:	103169826
Reduced:	NF3C16H22 (1)
Stoich.:	AB3C16D22 (1)
Weight, g/mol:	281.181336
ΔH_f, kcal/mol:	-157.86
Dipole, Da:	4.99
IP(EA), eV:	-9.1(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-ethoxycyclobutyl)-1-(2-methylthiophen-3-yl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCNC(CC1CCC1)C2=C(C=C(C=C2)C(F)(F)F)C

DOS

IR

Vibrations