Geometry & MOs

Info

ID:	351148
PubChem CID:	127279706
Reduced:	SO2N3C21H21 (1)
Stoich.:	AB2C3D21E21 (1)
Weight, g/mol:	398.166414
ΔH_f, kcal/mol:	0.0
Dipole, Da:	6.1
IP(EA), eV:	-8.8(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)N3C(=CC=N3)NC(=O)C4=CC5=C(S4)CCOC5

DOS

IR

Vibrations