Geometry & MOs

Info

ID:	244543
PubChem CID:	99364875
Reduced:	N2O2C11H11 (2)
Stoich.:	A2B2C11D11 (2)
Weight, g/mol:	414.134635
ΔH_f, kcal/mol:	15.22
Dipole, Da:	6.48
IP(EA), eV:	-9.01(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-5-ethoxy-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]-4-propoxybenzamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NCC2=NOC(=C2)C3=CC=CC=C3)C4=CC=CC=C4[N+](=O)[O-]

DOS

IR

Vibrations