Geometry & MOs

Info

ID:	359509
PubChem CID:	127298783
Reduced:	SO2N3C21H29 (1)
Stoich.:	AB2C3D21E29 (1)
Weight, g/mol:	365.188546
ΔH_f, kcal/mol:	-53.7
Dipole, Da:	5.47
IP(EA), eV:	-8.94(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(thiomorpholine-4-carbonyl)pyrrolidin-1-yl]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(N(C1)CC(=O)NCC2(CC2)C3=CC=CC=C3)C(=O)N4CCSCC4

DOS

IR

Vibrations