Geometry & MOs

Info

ID:	195161
PubChem CID:	78646862
Reduced:	NO5C21H23 (1)
Stoich.:	AB5C21D23 (1)
Weight, g/mol:	364.118985
ΔH_f, kcal/mol:	-158.9
Dipole, Da:	2.82
IP(EA), eV:	-8.91(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[1-(3-chlorophenyl)ethylamino]-2-oxoethyl] 3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)OC

DOS

IR

Vibrations