Geometry & MOs

Info

ID:	71928
PubChem CID:	48415627
Reduced:	O2N5H21C22 (1)
Stoich.:	A2B5C21D22 (1)
Weight, g/mol:	389.185175
ΔH_f, kcal/mol:	45.26
Dipole, Da:	3.74
IP(EA), eV:	-8.92(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N(C)CCCC3=NC4=CC=CC=C4N3

DOS

IR

Vibrations