Geometry & MOs

Info

ID:	145576
PubChem CID:	53547675
Reduced:	ON5C19H29 (1)
Stoich.:	AB5C19D29 (1)
Weight, g/mol:	341.156184
ΔH_f, kcal/mol:	10.77
Dipole, Da:	4.96
IP(EA), eV:	-8.75(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-phenylsulfanyl-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1CNCC2=CN=C(C=C2)OC3CCCC3)N(C)C)C

DOS

IR

Vibrations