Geometry & MOs

Info

ID:	350401
PubChem CID:	127277763
Reduced:	SN2O2C14H24 (1)
Stoich.:	AB2C2D14E24 (1)
Weight, g/mol:	338.141262
ΔH_f, kcal/mol:	-108.39
Dipole, Da:	4.47
IP(EA), eV:	-9.16(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(oxolan-3-ylmethyl)pyrazol-3-yl]-3-propanoyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)N2CCCC(CC2)C

DOS

IR

Vibrations