Geometry & MOs

Info

ID:	72082
PubChem CID:	48415793
Reduced:	O3N5C21H21 (1)
Stoich.:	A3B5C21D21 (1)
Weight, g/mol:	418.200491
ΔH_f, kcal/mol:	-34.61
Dipole, Da:	2.9
IP(EA), eV:	-8.85(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3

DOS

IR

Vibrations