Geometry & MOs

Info

ID:	72047
PubChem CID:	48415752
Reduced:	O2N4H22C23 (1)
Stoich.:	A2B4C22D23 (1)
Weight, g/mol:	340.189926
ΔH_f, kcal/mol:	23.55
Dipole, Da:	2.16
IP(EA), eV:	-8.84(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N,3-dimethyl-5-propan-2-yl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=C(N=CC=C3)OC4=CC=CC=C4

DOS

IR

Vibrations