Geometry & MOs

Info

ID:	72308
PubChem CID:	48416029
Reduced:	O3N4C22H22 (1)
Stoich.:	A3B4C22D22 (1)
Weight, g/mol:	374.174276
ΔH_f, kcal/mol:	7.75
Dipole, Da:	5.72
IP(EA), eV:	-9.0(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=NOC(=C3)C4=CC=CC=C4OC

DOS

IR

Vibrations