Geometry & MOs

Info

ID:	390588
PubChem CID:	134999852
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	483.12642
ΔH_f, kcal/mol:	-42.23
Dipole, Da:	2.51
IP(EA), eV:	-8.36(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzhydryl (2S)-2-[[1-(2-amino-5-fluoro-1,3-thiazol-4-yl)-2-oxo-2-prop-2-enoxyethylidene]amino]oxypropanoate

Drug info:

PubChemData

Smile

CCN(CC)C(=N)C(=COCC)C1=CC=C(C=C1)OC

DOS

IR

Vibrations