Geometry & MOs

Info

ID:	73622
PubChem CID:	48419530
Reduced:	ClN2O4C18H23 (1)
Stoich.:	AB2C4D18E23 (1)
Weight, g/mol:	380.150285
ΔH_f, kcal/mol:	-112.5
Dipole, Da:	2.31
IP(EA), eV:	-8.33(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[1-(3,4-diethoxyphenyl)ethyl]propanamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C(C)NC(=O)CCC2=C(ON=C2C)Cl)OC

DOS

IR

Vibrations