Geometry & MOs

Info

ID:	198215
PubChem CID:	79067002
Reduced:	OSN2C16H26 (1)
Stoich.:	ABC2D16E26 (1)
Weight, g/mol:	236.188863
ΔH_f, kcal/mol:	-25.64
Dipole, Da:	1.01
IP(EA), eV:	-8.65(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(1-morpholin-4-ylcyclopentyl)but-3-yn-1-amine

Drug info:

PubChemData

Smile

CNC(CC1=CSC=C1)C2(CCCC2)N3CCOCC3

DOS

IR

Vibrations