Geometry & MOs

Info

ID:	276277
PubChem CID:	103821903
Reduced:	ClN3O3C16H24 (1)
Stoich.:	AB3C3D16E24 (1)
Weight, g/mol:	317.173942
ΔH_f, kcal/mol:	-150.32
Dipole, Da:	4.4
IP(EA), eV:	-8.6(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[3-(1,3-oxazol-5-yl)anilino]propyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCNC1=CC(=C(C=C1)Cl)C(=O)NC

DOS

IR

Vibrations