Geometry & MOs

Info

ID:	350579
PubChem CID:	127278614
Reduced:	O3N4C21H22 (1)
Stoich.:	A3B4C21D22 (1)
Weight, g/mol:	330.151433
ΔH_f, kcal/mol:	-52.64
Dipole, Da:	2.53
IP(EA), eV:	-8.45(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COC2=CC=CC=C2C1C(=O)NC3=CC4=C(C=C3)N=C(N4)N5CCOCC5

DOS

IR

Vibrations