Geometry & MOs

Info

ID:	352006
PubChem CID:	127282924
Reduced:	ON2C6H10 (3)
Stoich.:	AB2C6D10 (3)
Weight, g/mol:	397.149384
ΔH_f, kcal/mol:	-95.14
Dipole, Da:	3.25
IP(EA), eV:	-9.11(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(3-piperidin-1-ylsulfonylphenyl)methyl]thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC(=O)N2CCN(CC2)C(C)C(=O)NC3CCCC3

DOS

IR

Vibrations