Geometry & MOs

Info

ID:	231694
PubChem CID:	87574460
Reduced:	O3N5H19C23 (1)
Stoich.:	A3B5C19D23 (1)
Weight, g/mol:	419.209658
ΔH_f, kcal/mol:	33.73
Dipole, Da:	4.25
IP(EA), eV:	-8.57(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-cyclohexyl-2-[3-methyl-2-(oxiran-2-ylmethoxy)phenyl]-1H-indole-6-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC\3=C(C=CN/C3=C(\N)/N=O)N=C2C4=CC=C(C=C4)COC(=O)N

DOS

IR

Vibrations