Geometry & MOs

Info

ID:	364322
PubChem CID:	127315421
Reduced:	N3O3C19H31 (1)
Stoich.:	A3B3C19D31 (1)
Weight, g/mol:	383.097349
ΔH_f, kcal/mol:	-102.86
Dipole, Da:	7.13
IP(EA), eV:	-8.72(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-[(2S)-1-oxo-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-2-yl]-1,2-oxazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCC(C(=O)N1CCN(CC1)CC2=C(ON=C2C)C)OC3CCCC3

DOS

IR

Vibrations