Geometry & MOs

Info

ID:	136709
PubChem CID:	52087760
Reduced:	SN3O4H23C25 (1)
Stoich.:	AB3C4D23E25 (1)
Weight, g/mol:	473.195071
ΔH_f, kcal/mol:	-65.77
Dipole, Da:	3.56
IP(EA), eV:	-8.55(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-phenyl-1,3-oxazol-2-yl)-N-pyridin-2-yl-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide

Drug info:

PubChemData

Smile

C1CC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)CCC4=NC=C(O4)C5=CC=CC=C5

DOS

IR

Vibrations