Geometry & MOs

Info

ID:	146545
PubChem CID:	53703866
Reduced:	OC3H7 (2)
Stoich.:	AB3C7 (2)
Weight, g/mol:	473.135363
ΔH_f, kcal/mol:	-110.43
Dipole, Da:	1.12
IP(EA), eV:	-9.83(2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[[(2S)-3-(3-chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]benzoate

Drug info:

PubChemData

Smile

CCOCC(C)CO

DOS

IR

Vibrations