Geometry & MOs

Info

ID:	240724
PubChem CID:	93617202
Reduced:	SO3N4C15H24 (1)
Stoich.:	AB3C4D15E24 (1)
Weight, g/mol:	340.156912
ΔH_f, kcal/mol:	-80.47
Dipole, Da:	7.12
IP(EA), eV:	-9.03(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclopropyl(ethyl)amino]-N-[2-[(3S)-1,1-dioxothiolan-3-yl]-5-methylpyrazol-3-yl]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NC1=CC(=NN1[C@@H]2CCS(=O)(=O)C2)C)C3CC3

DOS

IR

Vibrations