Geometry & MOs

Info

ID:	155470
PubChem CID:	56365757
Reduced:	FSN2O2C24H29 (1)
Stoich.:	ABC2D2E24F29 (1)
Weight, g/mol:	434.231791
ΔH_f, kcal/mol:	-102.76
Dipole, Da:	3.86
IP(EA), eV:	-8.62(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-oxo-1-(3-pyrrolidin-1-ylanilino)pentan-2-yl]-5-phenyl-4,5-dihydro-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CCCN(C1CCN(CC1)C(=O)C2=CC=CC=C2)C(=O)CCSC3=CC=C(C=C3)F

DOS

IR

Vibrations