Geometry & MOs

Info

ID:	356842
PubChem CID:	127292382
Reduced:	SN4O4C12H22 (1)
Stoich.:	AB4C4D12E22 (1)
Weight, g/mol:	335.232125
ΔH_f, kcal/mol:	-182.25
Dipole, Da:	3.3
IP(EA), eV:	-9.69(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-(4-ethylpiperazin-1-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1C(=O)NC2CCCN(C2)S(=O)(=O)C

DOS

IR

Vibrations