Geometry & MOs

Info

ID:	281758
PubChem CID:	103914319
Reduced:	O2N3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	265.117021
ΔH_f, kcal/mol:	-51.96
Dipole, Da:	4.34
IP(EA), eV:	-9.77(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylsulfonylpropan-2-yl)-2-methylsulfanylcyclopentan-1-amine

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(C1=CC=C(C=C1)C#N)O

DOS

IR

Vibrations