Geometry & MOs

Info

ID:	202361
PubChem CID:	79663377
Reduced:	ON2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	265.124883
ΔH_f, kcal/mol:	-23.26
Dipole, Da:	7.92
IP(EA), eV:	-8.54(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-amino-1-(3-methylthiophen-2-yl)propyl]morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

CN(C)C1=C(C=C(C=C1)N)C(=O)N2CCOC(C2)C#N

DOS

IR

Vibrations