Geometry & MOs

Info

ID:	351123
PubChem CID:	127279681
Reduced:	SO2N3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	398.166414
ΔH_f, kcal/mol:	-41.76
Dipole, Da:	7.32
IP(EA), eV:	-8.83(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-6,7-dihydro-4H-thieno[3,2-c]pyran-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(C)N1C(=CC=N1)NC(=O)C2=CC3=C(S2)CCOC3

DOS

IR

Vibrations