Geometry & MOs

Info

ID:	72307
PubChem CID:	48416028
Reduced:	O3N4C18H20 (1)
Stoich.:	A3B4C18D20 (1)
Weight, g/mol:	390.169191
ΔH_f, kcal/mol:	-53.84
Dipole, Da:	3.55
IP(EA), eV:	-9.09(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CNC(=O)C3=COC=C3

DOS

IR

Vibrations