Geometry & MOs

Info

ID:	37831
PubChem CID:	8024942
Reduced:	OS2N4C15H18 (1)
Stoich.:	AB2C4D15E18 (1)
Weight, g/mol:	405.092932
ΔH_f, kcal/mol:	40.11
Dipole, Da:	5.45
IP(EA), eV:	-8.66(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC2=NN=C(S2)S[C@H](C)C(=O)NC3CC3

DOS

IR

Vibrations