Geometry & MOs

Info

ID:	155094
PubChem CID:	56320680
Reduced:	NO2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	424.199822
ΔH_f, kcal/mol:	-96.21
Dipole, Da:	3.78
IP(EA), eV:	-8.24(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC(=CO2)CCNC(=O)CC3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations