Geometry & MOs

Info

ID:	68696
PubChem CID:	46508913
Reduced:	O3N4C28H28 (1)
Stoich.:	A3B4C28D28 (1)
Weight, g/mol:	332.116092
ΔH_f, kcal/mol:	-22.19
Dipole, Da:	3.13
IP(EA), eV:	-8.38(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 1H-indole-2-carboxylate

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)COC(=O)C4=CC5=CC=CC=C5N4

DOS

IR

Vibrations