Geometry & MOs

Info

ID:	192330
PubChem CID:	78257057
Reduced:	N3O6H17C20 (1)
Stoich.:	A3B6C17D20 (1)
Weight, g/mol:	377.143607
ΔH_f, kcal/mol:	-170.91
Dipole, Da:	4.41
IP(EA), eV:	-9.06(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-(1H-indol-3-yl)-1-[5-(3-phenylprop-2-enylsulfanyl)-1,3,4-oxadiazol-2-yl]ethyl]azanium

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)C(=C)NC3=CC=CC(=C3)C(=O)O

DOS

IR

Vibrations