Geometry & MOs

Info

ID:	69912
PubChem CID:	47205746
Reduced:	N3O4C13H17 (1)
Stoich.:	A3B4C13D17 (1)
Weight, g/mol:	294.040734
ΔH_f, kcal/mol:	-94.49
Dipole, Da:	8.17
IP(EA), eV:	-9.16(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chlorophenyl)methyl 2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoacetate

Drug info:

PubChemData

Smile

CCCC(=O)NCC(=O)NC1=CC(=C(C=C1)C)[N+](=O)[O-]

DOS

IR

Vibrations