Geometry & MOs

Info

ID:	57725
PubChem CID:	24276830
Reduced:	SN3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	235.114319
ΔH_f, kcal/mol:	35.92
Dipole, Da:	6.27
IP(EA), eV:	-8.7(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-piperidin-1-yl-2-pyridin-3-ylethanethioamide

Drug info:

PubChemData

Smile

CCN(CC)C(C1=CN=CC=C1)C(=S)N

DOS

IR

Vibrations