Geometry & MOs

Info

ID:	281761
PubChem CID:	103914328
Reduced:	OSN3C14H27 (1)
Stoich.:	ABC3D14E27 (1)
Weight, g/mol:	229.11365
ΔH_f, kcal/mol:	-64.6
Dipole, Da:	3.99
IP(EA), eV:	-8.57(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylsulfonyl-N-pent-4-ynylcyclopentan-1-amine

Drug info:

PubChemData

Smile

CN(C)C(=O)N1CCC(CC1)NC2CCC(C2)SC

DOS

IR

Vibrations