Geometry & MOs

Info

ID:	351117
PubChem CID:	127279675
Reduced:	NSO3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	356.119464
ΔH_f, kcal/mol:	-115.94
Dipole, Da:	2.14
IP(EA), eV:	-9.24(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN(C(CO1)C)C(=O)C2=CC3=C(S2)CCOC3

DOS

IR

Vibrations