Geometry & MOs

Info

ID:	318079
PubChem CID:	126648899
Reduced:	N4O6C25H26 (1)
Stoich.:	A4B6C25D26 (1)
Weight, g/mol:	478.185235
ΔH_f, kcal/mol:	-123.69
Dipole, Da:	7.57
IP(EA), eV:	-9.1(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[benzylcarbamoyl(hydroxy)amino]-5-[3-(cyclohexanecarbonylamino)phenyl]-1,2-oxazole-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=C(C(=NO3)C(=O)O)N(C(=O)NCC4=CC=CC=C4)O

DOS

IR

Vibrations