Geometry & MOs

Info

ID:	351128
PubChem CID:	127279686
Reduced:	N2S2O3C18H24 (1)
Stoich.:	A2B2C3D18E24 (1)
Weight, g/mol:	345.139865
ΔH_f, kcal/mol:	-107.67
Dipole, Da:	8.09
IP(EA), eV:	-8.76(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)-6,7-dihydro-4H-thieno[3,2-c]pyran-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1=CC2=C(C=C1)N=CS2)S(=O)(=O)C3CCCCC3

DOS

IR

Vibrations