Geometry & MOs

Info

ID:	354869
PubChem CID:	127287629
Reduced:	O3N5C14H23 (1)
Stoich.:	A3B5C14D23 (1)
Weight, g/mol:	353.185175
ΔH_f, kcal/mol:	-84.23
Dipole, Da:	4.82
IP(EA), eV:	-9.45(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-ylamino]-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)ethanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C)(C)NCC(=O)NCC(=O)N2CCCC2

DOS

IR

Vibrations