Geometry & MOs

Info

ID:	360440
PubChem CID:	127301085
Reduced:	SO3N5C16H19 (1)
Stoich.:	AB3C5D16E19 (1)
Weight, g/mol:	336.107854
ΔH_f, kcal/mol:	-37.1
Dipole, Da:	6.82
IP(EA), eV:	-9.8(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethylpyrrolidin-1-yl)-N-(3-thiophen-3-yl-1,2,4-thiadiazol-5-yl)propanamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)NC(=O)C2=CC3=C(C=C2)N4C(=NS3(=O)=O)N=CN4

DOS

IR

Vibrations