Geometry & MOs

Info

ID:	351108
PubChem CID:	127279666
Reduced:	SO2N3C20H21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	342.103814
ΔH_f, kcal/mol:	-27.53
Dipole, Da:	2.18
IP(EA), eV:	-8.27(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC2=NC3=C(N2CC1)C=CC(=C3)NC(=O)C4=CC5=C(S4)CCOC5

DOS

IR

Vibrations