Geometry & MOs

Info

ID:	259596
PubChem CID:	103168867
Reduced:	NO2C16H31 (1)
Stoich.:	AB2C16D31 (1)
Weight, g/mol:	181.146664
ΔH_f, kcal/mol:	-122.88
Dipole, Da:	1.44
IP(EA), eV:	-8.8(2.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-ethoxycyclobutyl)-N-methylbut-3-yn-2-amine

Drug info:

PubChemData

Smile

CCNC(CCC1CCCO1)CC2CC(C2)OCC

DOS

IR

Vibrations