Geometry & MOs

Info

ID:	445216
PubChem CID:	135265056
Reduced:	NO3C26H31 (1)
Stoich.:	AB3C26D31 (1)
Weight, g/mol:	728.357385
ΔH_f, kcal/mol:	-40.56
Dipole, Da:	2.3
IP(EA), eV:	-8.32(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2,4-bis(phenylmethoxy)-5-propan-2-ylphenyl]-N-ethyl-4-[2-(2-morpholin-4-ylacetyl)-3,4-dihydro-1H-isoquinolin-6-yl]-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=C(C=C(C(=C1)CON(C)C)OCC2=CC=CC=C2)OCC3=CC=CC=C3

DOS

IR

Vibrations