Geometry & MOs

Info

ID:	371477
PubChem CID:	127346544
Reduced:	N3O4C20H25 (1)
Stoich.:	A3B4C20D25 (1)
Weight, g/mol:	301.179027
ΔH_f, kcal/mol:	-103.61
Dipole, Da:	3.09
IP(EA), eV:	-8.61(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(oxolan-3-yl)-N-[(1-propan-2-ylbenzimidazol-2-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)COC2=C(C=C(C=C2)C(=O)N3C4CCC3CC(C4)O)OC

DOS

IR

Vibrations